3-chloro-2,4-diphenylquinoline

C21H14ClN — CID 10781654

IUPAC3-chloro-2,4-diphenylquinoline
SMILESClc1c(-c2ccccc2)nc2ccccc2c1-c1ccccc1
InChIInChI=1S/C21H14ClN/c22-20-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)23-21(20)16-11-5-2-6-12-16/h1-14H
InChIKeyLPTKYUFBKASDOD-UHFFFAOYSA-N
MW315.80 g/mol
LogP6.22
Rot. Bonds2

About 3-chloro-2,4-diphenylquinoline

3-chloro-2,4-diphenylquinoline (PubChem CID 10781654) has the molecular formula C21H14ClN and a molecular weight of 315.80 g/mol. Its IUPAC name is 3-chloro-2,4-diphenylquinoline.

Molecular Properties

Compound Name3-chloro-2,4-diphenylquinoline
PubChem CID10781654
Molecular FormulaC21H14ClN
Molecular Weight315.80 g/mol
Exact Mass315.08
IUPAC Name3-chloro-2,4-diphenylquinoline
SMILESClc1c(-c2ccccc2)nc2ccccc2c1-c1ccccc1
InChIInChI=1S/C21H14ClN/c22-20-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)23-21(20)16-11-5-2-6-12-16/h1-14H
InChIKeyLPTKYUFBKASDOD-UHFFFAOYSA-N
XLogP6.22
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.80
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[5-(3-chloro-4-phenylquinolin-2-yl)furan-2-yl]methyl]acetamide
CID 71891239
4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline
CID 139651658
N-[3-(3-chloro-4-phenylquinolin-2-yl)-2,5-dimethylpyrrol-1-yl]benzamide
CID 2537871
4-chloro-5-phenylbenzo[c][2,7]naphthyridine
CID 10446974
10,21-diphenyl-9,20-diazahexacyclo[10.10.1.02,11.03,8.013,22.014,19]tricosa-2(11),3,5,7,9,13(22),14,16,18,20-decaene
CID 121476066
3-(aminomethyl)-4-phenylquinolin-2-amine
CID 10285988
5,8-dimethyl-6,7-dihydroquinolino[3,2-c]acridine;5,8-diphenyl-6,7-dihydroquinolino[3,2-c]acridine
CID 158548153
2-phenylquinoline-3,4-dicarboxylic acid
CID 71341092
2-chloro-1,3-diphenylnaphthalene
CID 12697982
bis(3,4-diphenylquinoline);hydrate
CID 139201276
4-chloro-6-fluoro-2-phenyl-3-pyridin-4-ylquinoline
CID 139651657
12-(4-chlorophenyl)acenaphthyleno[2,1-b]quinoline
CID 169081927

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2,4-diphenylquinoline?
The IUPAC name of 3-chloro-2,4-diphenylquinoline (CID 10781654) is 3-chloro-2,4-diphenylquinoline.
What is the SMILES notation for 3-chloro-2,4-diphenylquinoline?
The canonical SMILES for 3-chloro-2,4-diphenylquinoline is Clc1c(-c2ccccc2)nc2ccccc2c1-c1ccccc1.
What is the InChIKey of 3-chloro-2,4-diphenylquinoline?
The InChIKey is LPTKYUFBKASDOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14ClN/c22-20-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)23-21(20)16-11-5-2-6-12-16/h1-14H.
What are the key properties of 3-chloro-2,4-diphenylquinoline?
3-chloro-2,4-diphenylquinoline has a molecular weight of 315.80 g/mol, XLogP of 6.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2,4-diphenylquinoline is sourced from PubChem (CID 10781654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).