4-(4-chlorophenyl)-3-methyl-N-phenylaniline

C19H16ClN — CID 156563993

IUPAC4-(4-chlorophenyl)-3-methyl-N-phenylaniline
SMILESCc1cc(Nc2ccccc2)ccc1-c1ccc(Cl)cc1
InChIInChI=1S/C19H16ClN/c1-14-13-18(21-17-5-3-2-4-6-17)11-12-19(14)15-7-9-16(20)10-8-15/h2-13,21H,1H3
InChIKeyJQZGZMFYJLNHJI-UHFFFAOYSA-N
MW293.80 g/mol
LogP6.06
Rot. Bonds3

About 4-(4-chlorophenyl)-3-methyl-N-phenylaniline

4-(4-chlorophenyl)-3-methyl-N-phenylaniline (PubChem CID 156563993) has the molecular formula C19H16ClN and a molecular weight of 293.80 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-3-methyl-N-phenylaniline.

Molecular Properties

Compound Name4-(4-chlorophenyl)-3-methyl-N-phenylaniline
PubChem CID156563993
Molecular FormulaC19H16ClN
Molecular Weight293.80 g/mol
Exact Mass293.10
IUPAC Name4-(4-chlorophenyl)-3-methyl-N-phenylaniline
SMILESCc1cc(Nc2ccccc2)ccc1-c1ccc(Cl)cc1
InChIInChI=1S/C19H16ClN/c1-14-13-18(21-17-5-3-2-4-6-17)11-12-19(14)15-7-9-16(20)10-8-15/h2-13,21H,1H3
InChIKeyJQZGZMFYJLNHJI-UHFFFAOYSA-N
XLogP6.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.80
LogP ≤ 56.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Naphthalenamine, N-(3-chlorophenyl)-
CID 79528
N-(p-Tolyl)-2-naphthylamine
CID 229322
N-(3-chlorophenyl)naphthalen-1-amine
CID 24986190
Bis(3,4-dimethylphenyl)amine
CID 614511
Benzenamine, 4-(1-methyl-1-phenylethyl)-N-phenyl-
CID 3085677
1-[4-(4-Chlorophenyl)anilino]cyclopentane-1-carbonitrile
CID 266705
N-(3,4-dimethylphenyl)-N-tritylamine
CID 7122328
8-Chloro-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,2-g]quinoline
CID 15458739
N-[3-[4-(4-chlorophenyl)phenyl]propyl]-4-(piperidin-1-ylmethyl)aniline
CID 16745235
N-[1-(2-chlorophenyl)ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepin-7-amine
CID 86294717
4,4'-[(4-Chlorophenyl)methanediyl]bis(n,n-dimethylaniline)
CID 239113
1-Naphthalenamine, N-(nonylphenyl)-
CID 113241

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-3-methyl-N-phenylaniline?
The IUPAC name of 4-(4-chlorophenyl)-3-methyl-N-phenylaniline (CID 156563993) is 4-(4-chlorophenyl)-3-methyl-N-phenylaniline.
What is the SMILES notation for 4-(4-chlorophenyl)-3-methyl-N-phenylaniline?
The canonical SMILES for 4-(4-chlorophenyl)-3-methyl-N-phenylaniline is Cc1cc(Nc2ccccc2)ccc1-c1ccc(Cl)cc1.
What is the InChIKey of 4-(4-chlorophenyl)-3-methyl-N-phenylaniline?
The InChIKey is JQZGZMFYJLNHJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN/c1-14-13-18(21-17-5-3-2-4-6-17)11-12-19(14)15-7-9-16(20)10-8-15/h2-13,21H,1H3.
What are the key properties of 4-(4-chlorophenyl)-3-methyl-N-phenylaniline?
4-(4-chlorophenyl)-3-methyl-N-phenylaniline has a molecular weight of 293.80 g/mol, XLogP of 6.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-3-methyl-N-phenylaniline is sourced from PubChem (CID 156563993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).