[email protected]
CAS 3088-41-3 1-(2-Cyanoethyl)piperidine molecular structure lightbox
CAS RN: 3088-41-3

1-(2-Cyanoethyl)piperidine

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250822 100g In stock Inquiry
Batchno.20260606 1g In stock Inquiry
Batchno.20260226 25g In stock Inquiry
Batchno.20260522 5g In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260130 5g Out of stock 5-7 business days Inquiry
  • Product code: ICTC1313
  • Purity/Analytical Methods: >98.0%(GC)
GET A QUOTE

3088-41-3 / 3-piperidin-1-ylpropanenitrile

Standard CAS: 3088-41-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
3088-41-3
Multi CAS
Yes
Molecular Formula
C8H14N2
Molecular Weight
138.210000
Exact Mass
138.115698
InChI
InChI=1S/C8H14N2/c9-5-4-8-10-6-2-1-3-7-10/h1-4,6-8H2
InChIKey
YZICFVIUVMCCOC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.88
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
40.52
TPSA
27.03

LogP / Solubility

WLOGP
1.39
MLOGP
1.21
XLogP3
0.8
Consensus LogP
1.13
Log S (ESOL)
-1.44
Class (ESOL)
Soluble
Log S (Ali)
-1.69
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.95
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)
-2.58

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us