2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide

C25H20N2O3 — CID 139771930

IUPAC2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cc3ccc4c5ccccc5[nH]c4c3cc2O)cc1
InChIInChI=1S/C25H20N2O3/c1-30-18-9-7-17(8-10-18)26-24(29)13-16-12-15-6-11-20-19-4-2-3-5-22(19)27-25(20)21(15)14-23(16)28/h2-12,14,27-28H,13H2,1H3,(H,26,29)
InChIKeyGVXJLRFYWZYKID-UHFFFAOYSA-N
MW396.45 g/mol
LogP5.37
Rot. Bonds4

About 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide

2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide (PubChem CID 139771930) has the molecular formula C25H20N2O3 and a molecular weight of 396.45 g/mol. Its IUPAC name is 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide
PubChem CID139771930
Molecular FormulaC25H20N2O3
Molecular Weight396.45 g/mol
Exact Mass396.15
IUPAC Name2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cc3ccc4c5ccccc5[nH]c4c3cc2O)cc1
InChIInChI=1S/C25H20N2O3/c1-30-18-9-7-17(8-10-18)26-24(29)13-16-12-15-6-11-20-19-4-2-3-5-22(19)27-25(20)21(15)14-23(16)28/h2-12,14,27-28H,13H2,1H3,(H,26,29)
InChIKeyGVXJLRFYWZYKID-UHFFFAOYSA-N
XLogP5.37
TPSA74.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.45
LogP ≤ 55.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide 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

3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol
CID 44579437
2-(9H-carbazol-2-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 163300249
ethane;2-hydroxy-11H-benzo[a]carbazole-3-carboxylic acid
CID 91394685
2-(1H-indol-3-yl)-N-[4-[(4-methoxyphenyl)methylamino]phenyl]acetamide
CID 112982718
phenyl 2-hydroxy-11H-benzo[a]carbazole-3-carboxylate
CID 19933809
2-hydroxy-N-(3-methylphenyl)-11H-benzo[a]carbazole-3-carboxamide
CID 14008608
7-methoxy-3,15-diazahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4(9),5,7,11,14(22),16,18,20,23-undecaene
CID 24774105
2-hydroxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-11H-benzo[a]carbazole-3-carboxamide
CID 137495996
N-(4-methoxyphenyl)-2-(2-methylphenyl)acetamide
CID 6467093
3-amino-11H-benzo[a]carbazol-2-ol
CID 135394460
N-(4-methoxyphenyl)naphthalene-1-carboxamide;N-(4-methoxyphenyl)-2-naphthalen-2-ylacetamide
CID 143592435
[2-(4-methoxyanilino)-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate
CID 2573596

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide (CID 139771930) is 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)Cc2cc3ccc4c5ccccc5[nH]c4c3cc2O)cc1.
What is the InChIKey of 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide?
The InChIKey is GVXJLRFYWZYKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2O3/c1-30-18-9-7-17(8-10-18)26-24(29)13-16-12-15-6-11-20-19-4-2-3-5-22(19)27-25(20)21(15)14-23(16)28/h2-12,14,27-28H,13H2,1H3,(H,26,29).
What are the key properties of 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide?
2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide has a molecular weight of 396.45 g/mol, XLogP of 5.37, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 139771930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).