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CAS 885275-33-2 1-METHYL-2-PYRAZIN-2-YL-ETHYLAMINE molecular structure lightbox
CAS RN: 885275-33-2

1-METHYL-2-PYRAZIN-2-YL-ETHYLAMINE

  • Product code: SSC-199358
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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: ≥95%
  • 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 885275-33-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

885275-33-2 / 1-pyrazin-2-ylpropan-2-amine

Standard CAS: 885275-33-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
885275-33-2
Multi CAS
Yes
Molecular Formula
C7H11N3
Molecular Weight
137.180000
Exact Mass
137.095297
InChI
InChI=1S/C7H11N3/c1-6(8)4-7-5-9-2-3-10-7/h2-3,5-6H,4,8H2,1H3
InChIKey
NUCGDQSFJGMQQA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.43
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
39.39
TPSA
51.8

LogP / Solubility

WLOGP
0.37
MLOGP
0.31
XLogP3
-0.4
Consensus LogP
0.09
Log S (ESOL)
-1.23
Class (ESOL)
Soluble
Log S (Ali)
-0.95
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.1
Class (SILICOS-IT)
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)
-3.3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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