6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine

C27H22Cl2N2 — CID 171794178

IUPAC6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine
SMILESCCCn1c2ccc(Cl)cc2c2cc(-c3ccc(Cl)cc3)c(Nc3ccccc3)cc21
InChIInChI=1S/C27H22Cl2N2/c1-2-14-31-26-13-12-20(29)15-23(26)24-16-22(18-8-10-19(28)11-9-18)25(17-27(24)31)30-21-6-4-3-5-7-21/h3-13,15-17,30H,2,14H2,1H3
InChIKeyGIXJZAQITNAJOH-UHFFFAOYSA-N
MW445.39 g/mol
LogP8.92
Rot. Bonds5

About 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine

6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine (PubChem CID 171794178) has the molecular formula C27H22Cl2N2 and a molecular weight of 445.39 g/mol. Its IUPAC name is 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine.

Molecular Properties

Compound Name6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine
PubChem CID171794178
Molecular FormulaC27H22Cl2N2
Molecular Weight445.39 g/mol
Exact Mass444.12
IUPAC Name6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine
SMILESCCCn1c2ccc(Cl)cc2c2cc(-c3ccc(Cl)cc3)c(Nc3ccccc3)cc21
InChIInChI=1S/C27H22Cl2N2/c1-2-14-31-26-13-12-20(29)15-23(26)24-16-22(18-8-10-19(28)11-9-18)25(17-27(24)31)30-21-6-4-3-5-7-21/h3-13,15-17,30H,2,14H2,1H3
InChIKeyGIXJZAQITNAJOH-UHFFFAOYSA-N
XLogP8.92
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.39
LogP ≤ 58.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,5-dichloro-1-propylindol-3-yl)methanol
CID 82268729
2-[2-[2-anilino-3-(3,4-dichlorophenyl)-6-iodoiodanuidylcarbazol-9-yl]ethyl]guanidine
CID 171793831
4-(4-chlorophenyl)-3-methyl-N-phenylaniline
CID 156563993
9-hexadecyl-2-N,7-N-diphenylcarbazole-2,7-diamine
CID 102402065
9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine
CID 129125677
1-N,3-N-diphenyl-4,6-bis(9-phenylcarbazol-3-yl)benzene-1,3-diamine
CID 161099965
(2-anilino-4-chlorophenyl)boronic acid
CID 67831922
9-(2-aminoethyl)-6,7-dichloro-N-(4-chlorophenyl)carbazol-2-amine
CID 171793775
1-N-phenyl-4-N-[4-(9-phenylcarbazol-3-yl)phenyl]-2-(4-phenylphenyl)benzene-1,4-diamine
CID 175396320
2-but-1-en-2-yl-5-chloro-N-phenylaniline
CID 89037433
4-chloro-2-N-phenylbenzene-1,2-diamine
CID 526554
N,2-diphenyl-4-[3-phenyl-4-[4-(4-phenylphenyl)anilino]phenyl]aniline
CID 121262444

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine?
The IUPAC name of 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine (CID 171794178) is 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine.
What is the SMILES notation for 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine?
The canonical SMILES for 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine is CCCn1c2ccc(Cl)cc2c2cc(-c3ccc(Cl)cc3)c(Nc3ccccc3)cc21.
What is the InChIKey of 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine?
The InChIKey is GIXJZAQITNAJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22Cl2N2/c1-2-14-31-26-13-12-20(29)15-23(26)24-16-22(18-8-10-19(28)11-9-18)25(17-27(24)31)30-21-6-4-3-5-7-21/h3-13,15-17,30H,2,14H2,1H3.
What are the key properties of 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine?
6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine has a molecular weight of 445.39 g/mol, XLogP of 8.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(4-chlorophenyl)-N-phenyl-9-propylcarbazol-2-amine is sourced from PubChem (CID 171794178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).