(1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride

C19H25ClN2 — CID 170875383

IUPAC(1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride
SMILESCl.NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C19H24N2.ClH/c20-16-19(18-9-5-2-6-10-18)11-13-21(14-12-19)15-17-7-3-1-4-8-17;/h1-10H,11-16,20H2;1H
InChIKeyVTGQFLIMFSYNOM-UHFFFAOYSA-N
MW316.88 g/mol
LogP3.60
Rot. Bonds4

About (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride

(1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride (PubChem CID 170875383) has the molecular formula C19H25ClN2 and a molecular weight of 316.88 g/mol. Its IUPAC name is (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride
PubChem CID170875383
Molecular FormulaC19H25ClN2
Molecular Weight316.88 g/mol
Exact Mass316.17
IUPAC Name(1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride
SMILESCl.NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C19H24N2.ClH/c20-16-19(18-9-5-2-6-10-18)11-13-21(14-12-19)15-17-7-3-1-4-8-17;/h1-10H,11-16,20H2;1H
InChIKeyVTGQFLIMFSYNOM-UHFFFAOYSA-N
XLogP3.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.88
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-benzyl-4-(4-methoxyphenyl)piperidin-4-yl]methanamine
CID 95504616
4-(aminomethyl)-1-benzylpiperidin-4-ol;hydrochloride
CID 122236517
1-benzyl-4-(isocyanomethyl)-4-phenylpiperidine
CID 5115779
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]formamide
CID 23538
(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine
CID 21036983
1-benzyl-4-isocyano-4-phenylpiperidine
CID 20812471
[1-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]cyclopentyl]methanamine
CID 117464200
N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide
CID 20694800
1-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]-3,5-dimethylpiperazine
CID 59395187
1-benzyl-4-methoxy-4-phenylpiperidine
CID 170986894
(1-benzyl-4-methylsulfonylpiperidin-4-yl)methanamine
CID 99997092

Frequently Asked Questions

What is the IUPAC name of (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride?
The IUPAC name of (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride (CID 170875383) is (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride.
What is the SMILES notation for (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride?
The canonical SMILES for (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride is Cl.NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1.
What is the InChIKey of (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride?
The InChIKey is VTGQFLIMFSYNOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2.ClH/c20-16-19(18-9-5-2-6-10-18)11-13-21(14-12-19)15-17-7-3-1-4-8-17;/h1-10H,11-16,20H2;1H.
What are the key properties of (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride?
(1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride has a molecular weight of 316.88 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride is sourced from PubChem (CID 170875383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).