2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine

C36H25FN2 — CID 155051741

IUPAC2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine
SMILESFc1ccc(-c2cc3c(cc2N(c2ccccc2)c2ccccc2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C36H25FN2/c37-27-22-20-26(21-23-27)32-24-36-33(31-18-10-11-19-34(31)39(36)30-16-8-3-9-17-30)25-35(32)38(28-12-4-1-5-13-28)29-14-6-2-7-15-29/h1-25H
InChIKeyPPWXYNSBFQQDKY-UHFFFAOYSA-N
MW504.61 g/mol
LogP10.06
Rot. Bonds5

About 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine

2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine (PubChem CID 155051741) has the molecular formula C36H25FN2 and a molecular weight of 504.61 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine
PubChem CID155051741
Molecular FormulaC36H25FN2
Molecular Weight504.61 g/mol
Exact Mass504.20
IUPAC Name2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine
SMILESFc1ccc(-c2cc3c(cc2N(c2ccccc2)c2ccccc2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C36H25FN2/c37-27-22-20-26(21-23-27)32-24-36-33(31-18-10-11-19-34(31)39(36)30-16-8-3-9-17-30)25-35(32)38(28-12-4-1-5-13-28)29-14-6-2-7-15-29/h1-25H
InChIKeyPPWXYNSBFQQDKY-UHFFFAOYSA-N
XLogP10.06
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500504.61
LogP ≤ 510.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-bis(4-fluorophenyl)-2,9-diphenylcarbazol-3-amine;N-(2-isocyanophenyl)-N,2,9-triphenylcarbazol-3-amine;N-(4-isocyanophenyl)-N,2,9-triphenylcarbazol-3-amine
CID 161070068
N-[4-(2,9-diphenylcarbazol-3-yl)phenyl]-3-fluoro-N-phenylaniline
CID 155051690
N,N,2-triphenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 142704370
6-fluoro-N,9-diphenyl-N-(9-phenylcarbazol-2-yl)carbazol-2-amine
CID 138549150
7-fluoro-N,9-diphenyl-N-(9-phenylcarbazol-2-yl)carbazol-2-amine
CID 138549065
9-(4-fluorophenyl)-N-[4-[4-(N-[9-(4-fluorophenyl)carbazol-2-yl]-4-methylanilino)phenyl]phenyl]-N-phenylcarbazol-2-amine
CID 176642990
1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine
CID 58983384
1-N,3-N-bis(4-fluorophenyl)-1-N,3-N-diphenyl-5-(9-phenylcarbazol-2-yl)benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-diphenyl-5-(9-phenylcarbazol-2-yl)benzene-1,3-diamine;1-N,3-N-diphenyl-5-(9-phenylcarbazol-2-yl)-1-N,3-N-bis(4-phenylphenyl)benzene-1,3-diamine;5-(9-phenylcarbazol-2-yl)-1-N,1-N,3-N,3-N-tetrakis(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-(9-phenylcarbazol-2-yl)benzene-1,3-diamine;1-N,3-N,3-N-tris(4-methylphenyl)-1-N-phenyl-5-(9-phenylcarbazol-2-yl)benzene-1,3-diamine
CID 159393254
N-[4-(3,4-diphenylphenyl)phenyl]-N-(4-fluorophenyl)-3-(9-phenylcarbazol-3-yl)aniline
CID 164832089
N-(4-fluorophenyl)-N-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenylcarbazol-3-amine
CID 59181411
6-fluoro-N,9-diphenyl-N-(9-phenylcarbazol-2-yl)carbazol-1-amine
CID 138549018
9-phenyl-N-[4-(2-phenylphenyl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-2-amine
CID 172500939

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine?
The IUPAC name of 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine (CID 155051741) is 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine.
What is the SMILES notation for 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine?
The canonical SMILES for 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine is Fc1ccc(-c2cc3c(cc2N(c2ccccc2)c2ccccc2)c2ccccc2n3-c2ccccc2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine?
The InChIKey is PPWXYNSBFQQDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H25FN2/c37-27-22-20-26(21-23-27)32-24-36-33(31-18-10-11-19-34(31)39(36)30-16-8-3-9-17-30)25-35(32)38(28-12-4-1-5-13-28)29-14-6-2-7-15-29/h1-25H.
What are the key properties of 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine?
2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine has a molecular weight of 504.61 g/mol, XLogP of 10.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N,N,9-triphenylcarbazol-3-amine is sourced from PubChem (CID 155051741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).