[2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride

C16H14Cl2N2 — CID 82025623

IUPAC[2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride
SMILESCl.NCc1cc(-c2ccc(Cl)cc2)nc2ccccc12
InChIInChI=1S/C16H13ClN2.ClH/c17-13-7-5-11(6-8-13)16-9-12(10-18)14-3-1-2-4-15(14)19-16;/h1-9H,10,18H2;1H
InChIKeyYJOUNHMUWKAKFG-UHFFFAOYSA-N
MW305.21 g/mol
LogP4.44
Rot. Bonds2

About [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride

[2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride (PubChem CID 82025623) has the molecular formula C16H14Cl2N2 and a molecular weight of 305.21 g/mol. Its IUPAC name is [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride.

Molecular Properties

Compound Name[2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride
PubChem CID82025623
Molecular FormulaC16H14Cl2N2
Molecular Weight305.21 g/mol
Exact Mass304.05
IUPAC Name[2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride
SMILESCl.NCc1cc(-c2ccc(Cl)cc2)nc2ccccc12
InChIInChI=1S/C16H13ClN2.ClH/c17-13-7-5-11(6-8-13)16-9-12(10-18)14-3-1-2-4-15(14)19-16;/h1-9H,10,18H2;1H
InChIKeyYJOUNHMUWKAKFG-UHFFFAOYSA-N
XLogP4.44
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.21
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(4-chlorophenyl)quinolin-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

(2-phenylquinolin-4-yl)methanamine;hydrochloride
CID 82025622
N'-[2-(4-chlorophenyl)quinolin-4-yl]benzenecarboximidamide
CID 23251138
4-(4-chlorophenyl)-2-(4-fluorophenyl)quinoline
CID 56807096
2-(4-chlorophenyl)-4-ethoxyquinoline
CID 10880586
(2-methylquinolin-4-yl)methanamine;dihydrochloride
CID 42946478
1,3-bis(4-chlorophenyl)benzo[f]quinoline
CID 17201997
2-(4-chlorophenyl)-N-[2-[[2-(4-chlorophenyl)quinoline-4-carbonyl]amino]ethyl]quinoline-4-carboxamide
CID 5115230
(2-fluorophenyl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate
CID 7701146
[2-chloro-6-(4-chlorophenyl)-3-pyridinyl]methanamine;hydrochloride
CID 117071690
(2-phenylbenzo[h]quinolin-4-yl)methanamine
CID 122193009
2-phenylquinolin-4-amine;hydrochloride
CID 134690731
[2-(3,4-difluorophenyl)-2-oxoethyl] 2-(4-chlorophenyl)quinoline-4-carboxylate
CID 2114772

Frequently Asked Questions

What is the IUPAC name of [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride?
The IUPAC name of [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride (CID 82025623) is [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride.
What is the SMILES notation for [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride?
The canonical SMILES for [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride is Cl.NCc1cc(-c2ccc(Cl)cc2)nc2ccccc12.
What is the InChIKey of [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride?
The InChIKey is YJOUNHMUWKAKFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2.ClH/c17-13-7-5-11(6-8-13)16-9-12(10-18)14-3-1-2-4-15(14)19-16;/h1-9H,10,18H2;1H.
What are the key properties of [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride?
[2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride has a molecular weight of 305.21 g/mol, XLogP of 4.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chlorophenyl)quinolin-4-yl]methanamine;hydrochloride is sourced from PubChem (CID 82025623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).