N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide

C19H19N3O2 — CID 110762600

IUPACN-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2c(C)n(C)c3ccccc23)c1
InChIInChI=1S/C19H19N3O2/c1-12-18(16-9-4-5-10-17(16)22(12)3)19(24)21-15-8-6-7-14(11-15)20-13(2)23/h4-11H,1-3H3,(H,20,23)(H,21,24)
InChIKeyOYYMCOSZFCVUSD-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.70
Rot. Bonds3

About N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide

N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide (PubChem CID 110762600) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide
PubChem CID110762600
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2c(C)n(C)c3ccccc23)c1
InChIInChI=1S/C19H19N3O2/c1-12-18(16-9-4-5-10-17(16)22(12)3)19(24)21-15-8-6-7-14(11-15)20-13(2)23/h4-11H,1-3H3,(H,20,23)(H,21,24)
InChIKeyOYYMCOSZFCVUSD-UHFFFAOYSA-N
XLogP3.70
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetamidophenyl)-2,6-dihydroxybenzamide
CID 103748896
N-(4-acetamidophenyl)-2-(1,2-dimethylindol-3-yl)acetamide
CID 110768882
4-hydroxy-1-methyl-2-oxo-N-phenylquinoline-3-carboxamide
CID 54676449
N-(3-acetamidophenyl)-3-methyl-4-oxophthalazine-1-carboxamide
CID 2666384
N-[3-(9-methylpyridazino[3,4-b]indol-3-yl)phenyl]acetamide
CID 101072823
N-(3-chlorophenyl)-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694528
N-(3-acetamidophenyl)-3-(4-oxocinnolin-1-yl)propanamide
CID 51254626
N-(3-acetamidophenyl)-2-chlorobenzamide
CID 792012
N-(3-acetamidophenyl)-3-methylbenzamide
CID 766081
N-(3-acetamidophenyl)-3-pyrrol-1-ylpropanamide
CID 110688727
(1,2-dimethylindol-3-yl)-(1-methylindol-3-yl)methanone
CID 23544603
N'-(3-acetamidophenyl)-N-phenyloxamide
CID 45001278

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide (CID 110762600) is N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide is CC(=O)Nc1cccc(NC(=O)c2c(C)n(C)c3ccccc23)c1.
What is the InChIKey of N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide?
The InChIKey is OYYMCOSZFCVUSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-12-18(16-9-4-5-10-17(16)22(12)3)19(24)21-15-8-6-7-14(11-15)20-13(2)23/h4-11H,1-3H3,(H,20,23)(H,21,24).
What are the key properties of N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide?
N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-1,2-dimethylindole-3-carboxamide is sourced from PubChem (CID 110762600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).