CAS RN: 915226-72-1
(S)-3-Cyanopiperidine hydrochloride
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260225 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS915226-72-1
- Purity/Analytical Methods: >99.0%
915226-72-1 / piperidine-3-carbonitrile;hydrochloride
Basic Information
CAS
915226-72-1
Multi CAS
Yes
Molecular Formula
C6H11CLN2
Molecular Weight
146.620000
Exact Mass
146.061076
InChI
InChI=1S/C6H10N2.ClH/c7-4-6-2-1-3-8-5-6;/h6,8H,1-3,5H2;1H/t6-;/m1./s1
InChIKey
UGNVDGLCOHDISF-FYZOBXCZSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.83
H-bond acceptors
2
H-bond donors
1
Molar refractivity
38.45
TPSA
35.82
LogP / Solubility
WLOGP
0.93
MLOGP
0.81
XLogP3
0.93
Consensus LogP
0.89
Log S (ESOL)
-1.34
Class (ESOL)
Soluble
Log S (Ali)
-1.43
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.39
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)
-2.95
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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