N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine

C39H25N3O — CID 170177369

IUPACN-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine
SMILESc1ccc(N(c2cccc(-n3c4ccccc4c4cc5ccccc5cc43)c2)c2nccc3c2oc2ccccc23)cc1
InChIInChI=1S/C39H25N3O/c1-2-13-28(14-3-1)41(39-38-33(21-22-40-39)32-18-7-9-20-37(32)43-38)29-15-10-16-30(25-29)42-35-19-8-6-17-31(35)34-23-26-11-4-5-12-27(26)24-36(34)42/h1-25H
InChIKeyPKYWOCUZMHBNOX-UHFFFAOYSA-N
MW551.65 g/mol
LogP10.70
Rot. Bonds4

About N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine

N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine (PubChem CID 170177369) has the molecular formula C39H25N3O and a molecular weight of 551.65 g/mol. Its IUPAC name is N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine.

Molecular Properties

Compound NameN-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine
PubChem CID170177369
Molecular FormulaC39H25N3O
Molecular Weight551.65 g/mol
Exact Mass551.20
IUPAC NameN-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine
SMILESc1ccc(N(c2cccc(-n3c4ccccc4c4cc5ccccc5cc43)c2)c2nccc3c2oc2ccccc23)cc1
InChIInChI=1S/C39H25N3O/c1-2-13-28(14-3-1)41(39-38-33(21-22-40-39)32-18-7-9-20-37(32)43-38)29-15-10-16-30(25-29)42-35-19-8-6-17-31(35)34-23-26-11-4-5-12-27(26)24-36(34)42/h1-25H
InChIKeyPKYWOCUZMHBNOX-UHFFFAOYSA-N
XLogP10.70
TPSA34.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500551.65
LogP ≤ 510.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-benzo[c]carbazol-7-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine
CID 170177421
3-benzo[b]carbazol-5-yl-N-[4-([1]benzofuro[2,3-c]pyridin-1-yl)phenyl]-N-phenylaniline
CID 170177363
N-(4-dibenzofuran-4-ylphenyl)-5-phenyl-N-(4-phenylphenyl)benzo[b]carbazol-3-amine
CID 139571792
3-carbazol-9-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;3-carbazol-9-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]aniline;3-carbazol-9-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 158979073
N-(3-carbazol-9-ylphenyl)-3-dibenzofuran-4-yl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 168798261
1-N-naphtho[2,3-b][1]benzofuran-2-yl-1-N,4-N-diphenyl-4-N-(9-phenylcarbazol-2-yl)benzene-1,4-diamine;4-N-naphtho[2,3-b][1]benzofuran-1-yl-1-N,4-N-diphenyl-1-N-(9-phenylcarbazol-2-yl)benzene-1,4-diamine;4-N-naphtho[2,3-b][1]benzofuran-3-yl-1-N,4-N-diphenyl-1-N-(9-phenylcarbazol-2-yl)benzene-1,4-diamine;4-N-naphtho[2,3-b][1]benzofuran-4-yl-1-N,4-N-diphenyl-1-N-(9-phenylcarbazol-2-yl)benzene-1,4-diamine
CID 165100734
N-[4-(2-benzo[b]carbazol-5-yldibenzofuran-4-yl)phenyl]-N,4-diphenylaniline
CID 156558653
N,9-diphenyl-N-(5,15,25-trioxaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-yl)carbazol-2-amine
CID 170235145
5-[3-[3-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]benzo[b]carbazole
CID 166916866
8-N,22-N-bis(3-carbazol-9-ylphenyl)-8-N,22-N-di(dibenzofuran-3-yl)-5,15,25-trioxaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19(24),20,22,26-dodecaene-8,22-diamine
CID 164999307
3-carbazol-9-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 168789400
N-(17-carbazol-9-yl-6-pentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaenyl)-N-phenyldibenzofuran-4-amine
CID 166032307

Frequently Asked Questions

What is the IUPAC name of N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine?
The IUPAC name of N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine (CID 170177369) is N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine.
What is the SMILES notation for N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine?
The canonical SMILES for N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine is c1ccc(N(c2cccc(-n3c4ccccc4c4cc5ccccc5cc43)c2)c2nccc3c2oc2ccccc23)cc1.
What is the InChIKey of N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine?
The InChIKey is PKYWOCUZMHBNOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H25N3O/c1-2-13-28(14-3-1)41(39-38-33(21-22-40-39)32-18-7-9-20-37(32)43-38)29-15-10-16-30(25-29)42-35-19-8-6-17-31(35)34-23-26-11-4-5-12-27(26)24-36(34)42/h1-25H.
What are the key properties of N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine?
N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine has a molecular weight of 551.65 g/mol, XLogP of 10.70, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzo[b]carbazol-5-ylphenyl)-N-phenyl-[1]benzofuro[2,3-c]pyridin-1-amine is sourced from PubChem (CID 170177369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).