1-chloro-N,N-diphenyl-9H-carbazol-2-amine

C24H17ClN2 — CID 154703905

IUPAC1-chloro-N,N-diphenyl-9H-carbazol-2-amine
SMILESClc1c(N(c2ccccc2)c2ccccc2)ccc2c1[nH]c1ccccc12
InChIInChI=1S/C24H17ClN2/c25-23-22(16-15-20-19-13-7-8-14-21(19)26-24(20)23)27(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-16,26H
InChIKeyLNYRZDWYYYSCHB-UHFFFAOYSA-N
MW368.87 g/mol
LogP7.44
Rot. Bonds3

About 1-chloro-N,N-diphenyl-9H-carbazol-2-amine

1-chloro-N,N-diphenyl-9H-carbazol-2-amine (PubChem CID 154703905) has the molecular formula C24H17ClN2 and a molecular weight of 368.87 g/mol. Its IUPAC name is 1-chloro-N,N-diphenyl-9H-carbazol-2-amine.

Molecular Properties

Compound Name1-chloro-N,N-diphenyl-9H-carbazol-2-amine
PubChem CID154703905
Molecular FormulaC24H17ClN2
Molecular Weight368.87 g/mol
Exact Mass368.11
IUPAC Name1-chloro-N,N-diphenyl-9H-carbazol-2-amine
SMILESClc1c(N(c2ccccc2)c2ccccc2)ccc2c1[nH]c1ccccc12
InChIInChI=1S/C24H17ClN2/c25-23-22(16-15-20-19-13-7-8-14-21(19)26-24(20)23)27(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-16,26H
InChIKeyLNYRZDWYYYSCHB-UHFFFAOYSA-N
XLogP7.44
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.87
LogP ≤ 57.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

9H-carbazole;bis(N,N-diphenylaniline)
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1-N-(4-aminophenyl)-1-N-phenyl-9H-carbazole-1,4-diamine
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CID 166135032
N-(3-chlorophenyl)-N-(4-naphthalen-2-ylphenyl)-9H-carbazol-1-amine
CID 155096645
N,N-diphenyl-2-[3-phenyl-1-[2-(N-phenylanilino)phenyl]-9H-carbazol-2-yl]aniline
CID 166133960
9H-carbazole;N,N-diphenylaniline;pyridine
CID 175394994
2-chloro-1-methyl-9H-carbazole
CID 154342995
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2-(9H-carbazol-1-yl)-N,N-diphenylaniline;oxadiazole
CID 162008571
2-chloro-9H-carbazole-1-carboxylic acid
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2-(9H-carbazol-1-yl)-N,N-bis[2-(9H-carbazol-1-yl)phenyl]aniline
CID 68812374

Frequently Asked Questions

What is the IUPAC name of 1-chloro-N,N-diphenyl-9H-carbazol-2-amine?
The IUPAC name of 1-chloro-N,N-diphenyl-9H-carbazol-2-amine (CID 154703905) is 1-chloro-N,N-diphenyl-9H-carbazol-2-amine.
What is the SMILES notation for 1-chloro-N,N-diphenyl-9H-carbazol-2-amine?
The canonical SMILES for 1-chloro-N,N-diphenyl-9H-carbazol-2-amine is Clc1c(N(c2ccccc2)c2ccccc2)ccc2c1[nH]c1ccccc12.
What is the InChIKey of 1-chloro-N,N-diphenyl-9H-carbazol-2-amine?
The InChIKey is LNYRZDWYYYSCHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17ClN2/c25-23-22(16-15-20-19-13-7-8-14-21(19)26-24(20)23)27(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-16,26H.
What are the key properties of 1-chloro-N,N-diphenyl-9H-carbazol-2-amine?
1-chloro-N,N-diphenyl-9H-carbazol-2-amine has a molecular weight of 368.87 g/mol, XLogP of 7.44, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-N,N-diphenyl-9H-carbazol-2-amine is sourced from PubChem (CID 154703905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).