CAS RN: 97311-87-0

Cis-(1R,2S)-2-methylcyclopropanamine hydrochloride

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Batchno.20260121 100mg / 250mg / 500mg Out of stock 1 business days Inquiry
  • Product code: starshine_CAS97311-87-0
  • Purity/Analytical Methods: >99.0%
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97311-87-0 / 2-methylcyclopropan-1-amine;hydrochloride

Standard CAS: 97311-87-0 Multi CAS: Yes

Basic Information

CAS
97311-87-0
Multi CAS
Yes
Molecular Formula
C4H10CLN
Molecular Weight
107.580000
Exact Mass
107.050177
InChI
InChI=1S/C4H9N.ClH/c1-3-2-4(3)5;/h3-4H,2,5H2,1H3;1H
InChIKey
DGEKNIYQAIAEGO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
29
TPSA
26.02

LogP / Solubility

WLOGP
0.78
MLOGP
0.67
XLogP3
0.78
Consensus LogP
0.74
Log S (ESOL)
-1
Class (ESOL)
Very soluble
Log S (Ali)
-1
Class (Ali)
Soluble
Log S (SILICOS-IT)
-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)
-2.83

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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