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CAS 1427475-24-8 2-(1-Piperidyl)benzylaMine Hydrochloride molecular structure lightbox
CAS RN: 1427475-24-8

2-(1-Piperidyl)benzylaMine Hydrochloride

  • Product code: SSC-053937
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1427475-24-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 2 In Stock Beijing Inquiry
0.25g >95% 2 In Stock Shenzhen Inquiry
1g >95% 2 In Stock Hong Kong Inquiry
5g >95% 1 In Stock Beijing Inquiry

1427475-24-8 / (2-piperidin-1-ylphenyl)methanamine;hydrochloride

Standard CAS: 1427475-24-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1427475-24-8
Multi CAS
No
Molecular Formula
C12H19ClN2
Molecular Weight
226.740000
Exact Mass
226.123676
SMILES
C1CCN(CC1)C2=CC=CC=C2CN.Cl
InChI
InChI=1S/C12H18N2.ClH/c13-10-11-6-2-3-7-12(11)14-8-4-1-5-9-14;/h2-3,6-7H,1,4-5,8-10,13H2;1H
InChIKey
MAOJQJLMJVQRBE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
67.65
TPSA
29.26

LogP / Solubility

WLOGP
2.56
MLOGP
2.25
XLogP3
2.56
Consensus LogP
2.46
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.27
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.5
Class (SILICOS-IT)
Poorly 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)
-2.29

Drug-likeness / Medicinal Chemistry

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

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