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CAS 1060807-28-4 1-(2-METHOXYPYRIDIN-4-YL)ETHANAMINE molecular structure lightbox
CAS RN: 1060807-28-4

1-(2-METHOXYPYRIDIN-4-YL)ETHANAMINE

  • Product code: SSC-007797
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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 1060807-28-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1060807-28-4 / 1-(2-methoxy-4-pyridinyl)ethanamine

1-(2-METHOXYPYRIDIN-4-YL)ETHANAMINE | MFCD13188773 | 1-(2-METHOXYPYRIDIN-4-YL)ETHAN-1-AMINE

Standard CAS: 1060807-28-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1060807-28-4
Multi CAS
Yes
Molecular Formula
C8H12N2O
Molecular Weight
152.190000
Exact Mass
152.094963
SMILES
CC(C1=CC(=NC=C1)OC)N
InChI
InChI=1S/C8H12N2O/c1-6(9)7-3-4-10-8(5-7)11-2/h3-6H,9H2,1-2H3
InChIKey
FFQSFIMSXWJIAT-UHFFFAOYSA-N
Synonyms
1-(2-METHOXYPYRIDIN-4-YL)ETHANAMINE MFCD13188773 1-(2-METHOXYPYRIDIN-4-YL)ETHAN-1-AMINE 1-(2-methoxy-4-pyridyl)ethanamine SCHEMBL22369466

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
43.39
TPSA
48.14

LogP / Solubility

WLOGP
1.11
MLOGP
0.97
XLogP3
0.4
Consensus LogP
0.83
Log S (ESOL)
-1.75
Class (ESOL)
Soluble
Log S (Ali)
-1.61
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.81
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)
-2.86

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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