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CAS 1083246-53-0 N-Methyl-2-pyrimidinemethanamine molecular structure lightbox
CAS RN: 1083246-53-0

N-Methyl-2-pyrimidinemethanamine

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260328 50mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-009707
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1083246-53-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

1083246-53-0 / N-methyl-1-pyrimidin-2-ylmethanamine

4-Methyl-2-pyrimidinemethanamine | RefChem:294265 | (4-METHYLPYRIMIDIN-2-YL)METHANAMINE

Standard CAS: 1083246-53-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1083246-53-0
Multi CAS
Yes
Molecular Formula
C6H9N3
Molecular Weight
123.160000
Exact Mass
123.079647
SMILES
CNCC1=NC=CC=N1
InChI
InChI=1S/C6H9N3/c1-7-5-6-8-3-2-4-9-6/h2-4,7H,5H2,1H3
InChIKey
UYNVZHWHWPHYHA-UHFFFAOYSA-N
Synonyms
4-Methyl-2-pyrimidinemethanamine RefChem:294265 (4-METHYLPYRIMIDIN-2-YL)METHANAMINE C-(4-METHYL-PYRIMIDIN-2-YL)-METHYLAMINE 2-Pyrimidinemethanamine, 4-methyl-

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
34.8
TPSA
37.81

LogP / Solubility

WLOGP
0.2
MLOGP
0.16
XLogP3
-0.4
Consensus LogP
-0.01
Log S (ESOL)
-1.09
Class (ESOL)
Soluble
Log S (Ali)
-0.71
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.86
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.33

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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