CAS RN: 14156-91-3

3-(3-METHYL-PIPERIDIN-1-YL)-PROPYLAMINE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260111 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS14156-91-3
  • Purity/Analytical Methods: >99.0%
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14156-91-3 / 3-(3-methylpiperidin-1-yl)propan-1-amine

Standard CAS: 14156-91-3 Multi CAS: No

Basic Information

CAS
14156-91-3
Multi CAS
No
Molecular Formula
C9H20N2
Molecular Weight
156.270000
Exact Mass
156.162649
SMILES
CC1CCCN(C1)CCCN
InChI
InChI=1S/C9H20N2/c1-9-4-2-6-11(8-9)7-3-5-10/h9H,2-8,10H2,1H3
InChIKey
ADIQUBKLXXCKLT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
48.51
TPSA
29.26

LogP / Solubility

WLOGP
1.07
MLOGP
0.93
XLogP3
1
Consensus LogP
1
Log S (ESOL)
-1.28
Class (ESOL)
Soluble
Log S (Ali)
-1.61
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.92
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)
-2.92

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501

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