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CAS 1213130-14-3 (1R)-1-(3-METHYL(2-PYRIDYL))ETHYLAMINE molecular structure lightbox
CAS RN: 1213130-14-3

(1R)-1-(3-METHYL(2-PYRIDYL))ETHYLAMINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250810 50mg / 100mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1213130-14-3
  • Purity/Analytical Methods: >99.0%
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1213130-14-3 / (1R)-1-(3-methyl-2-pyridinyl)ethanamine

(R)-1-(3-Methylpyridin-2-yl)ethanamine | (1R)-1-(3-methylpyridin-2-yl)ethan-1-amine | (R)-1-(3-METHYLPYRIDIN-2-YL)ETHAN-1-AMINE

Standard CAS: 1213130-14-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1213130-14-3
Multi CAS
Yes
Molecular Formula
C8H12N2
Molecular Weight
136.190000
Exact Mass
136.100048
SMILES
CC1=C(N=CC=C1)[C@@H](C)N
InChI
InChI=1S/C8H12N2/c1-6-4-3-5-10-8(6)7(2)9/h3-5,7H,9H2,1-2H3/t7-/m1/s1
InChIKey
PWLIYNAODUMYSS-SSDOTTSWSA-N
Synonyms
(R)-1-(3-Methylpyridin-2-yl)ethanamine (1R)-1-(3-methylpyridin-2-yl)ethan-1-amine (R)-1-(3-METHYLPYRIDIN-2-YL)ETHAN-1-AMINE MFCD09256732 (1R)-1-(3-METHYL(2-PYRIDYL))ETHYLAMINE

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
41.58
TPSA
38.91

LogP / Solubility

WLOGP
1.41
MLOGP
1.23
XLogP3
0.5
Consensus LogP
1.05
Log S (ESOL)
-1.95
Class (ESOL)
Soluble
Log S (Ali)
-1.69
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.84
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)
-2.55

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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