9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide

C33H26N2O2 — CID 22741129

IUPAC9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1c(O)cc(-c3ccccc3)cc1n2Cc1ccccc1Cc1ccccc1
InChIInChI=1S/C33H26N2O2/c34-33(37)27-16-9-17-28-31(27)32-29(19-26(20-30(32)36)23-12-5-2-6-13-23)35(28)21-25-15-8-7-14-24(25)18-22-10-3-1-4-11-22/h1-17,19-20,36H,18,21H2,(H2,34,37)
InChIKeyGXZDYMCSULIACO-UHFFFAOYSA-N
MW482.58 g/mol
LogP6.91
Rot. Bonds6

About 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide

9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide (PubChem CID 22741129) has the molecular formula C33H26N2O2 and a molecular weight of 482.58 g/mol. Its IUPAC name is 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide.

Molecular Properties

Compound Name9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide
PubChem CID22741129
Molecular FormulaC33H26N2O2
Molecular Weight482.58 g/mol
Exact Mass482.20
IUPAC Name9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1c(O)cc(-c3ccccc3)cc1n2Cc1ccccc1Cc1ccccc1
InChIInChI=1S/C33H26N2O2/c34-33(37)27-16-9-17-28-31(27)32-29(19-26(20-30(32)36)23-12-5-2-6-13-23)35(28)21-25-15-8-7-14-24(25)18-22-10-3-1-4-11-22/h1-17,19-20,36H,18,21H2,(H2,34,37)
InChIKeyGXZDYMCSULIACO-UHFFFAOYSA-N
XLogP6.91
TPSA68.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.58
LogP ≤ 56.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-hydroxy-7-phenyl-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide
CID 22741264
9-[(2-benzylphenyl)methyl]-7-(hydroxymethyl)carbazole-4-carboxamide
CID 174417531
9-benzyl-5-hydroxy-7-methylcarbazole-4-carboxamide
CID 22739371
9-[(2-benzylphenyl)methyl]-7-propan-2-ylcarbazole-4-carboxamide
CID 174401296
7-(4-chlorophenyl)-9-[(3-cyanophenyl)methyl]-5-hydroxycarbazole-4-carboxamide
CID 22741187
2-[5-carbamoyl-9-[(3-carbamoylphenyl)methyl]-2-phenylcarbazol-4-yl]oxyacetic acid
CID 70241092
2-[9-benzyl-5-carbamoyl-2-(4-chlorophenyl)carbazol-4-yl]-2-hydroxyacetic acid
CID 141226865
9-[(3,5-dimethylphenyl)methyl]-5-hydroxycarbazole-4-carboxamide
CID 22739095
7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide
CID 22738776
7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide
CID 175233517
9-[(4-chlorophenyl)methyl]-7-phenylcarbazole-4-carboxamide
CID 174400985
9-[(4-methylphenyl)methyl]-7-phenylcarbazole-4-carboxamide
CID 174424042

Frequently Asked Questions

What is the IUPAC name of 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide?
The IUPAC name of 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide (CID 22741129) is 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide.
What is the SMILES notation for 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide?
The canonical SMILES for 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide is NC(=O)c1cccc2c1c1c(O)cc(-c3ccccc3)cc1n2Cc1ccccc1Cc1ccccc1.
What is the InChIKey of 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide?
The InChIKey is GXZDYMCSULIACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26N2O2/c34-33(37)27-16-9-17-28-31(27)32-29(19-26(20-30(32)36)23-12-5-2-6-13-23)35(28)21-25-15-8-7-14-24(25)18-22-10-3-1-4-11-22/h1-17,19-20,36H,18,21H2,(H2,34,37).
What are the key properties of 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide?
9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide has a molecular weight of 482.58 g/mol, XLogP of 6.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2-benzylphenyl)methyl]-5-hydroxy-7-phenylcarbazole-4-carboxamide is sourced from PubChem (CID 22741129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).