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CAS 141652-76-8 4-AMINO-1-METHYLPIPERIDINE-4-CARBOXYLIC ACID HCL molecular structure lightbox
CAS RN: 141652-76-8

4-AMINO-1-METHYLPIPERIDINE-4-CARBOXYLIC ACID HCL

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250218 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS141652-76-8
  • Purity/Analytical Methods: >99.0%
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141652-76-8 / 4-amino-1-methylpiperidine-4-carboxylic acid;hydrochloride

Standard CAS: 141652-76-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
141652-76-8
Multi CAS
No
Molecular Formula
C7H15ClN2O2
Molecular Weight
194.660000
Exact Mass
194.082205
SMILES
CN1CCC(CC1)(C(=O)O)N.Cl
InChI
InChI=1S/C7H14N2O2.ClH/c1-9-4-2-7(8,3-5-9)6(10)11;/h2-5,8H2,1H3,(H,10,11);1H
InChIKey
XRWYZBFKITZARO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.86
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
48.53
TPSA
66.56

LogP / Solubility

WLOGP
-0.08
MLOGP
-0.07
XLogP3
-0.08
Consensus LogP
-0.08
Log S (ESOL)
-0.93
Class (ESOL)
Very soluble
Log S (Ali)
-1.1
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.98
Class (SILICOS-IT)
Very 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)
-3.97

Drug-likeness / Medicinal Chemistry

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

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