1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide

C19H20N2O4 — CID 51265763

IUPAC1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide
SMILESCOc1cc(NC(=O)c2ccc3c(c2)CCN3C(C)=O)cc(OC)c1
InChIInChI=1S/C19H20N2O4/c1-12(22)21-7-6-13-8-14(4-5-18(13)21)19(23)20-15-9-16(24-2)11-17(10-15)25-3/h4-5,8-11H,6-7H2,1-3H3,(H,20,23)
InChIKeyXHSFAYKJMMMWMS-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.87
Rot. Bonds4

About 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide

1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide (PubChem CID 51265763) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide
PubChem CID51265763
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide
SMILESCOc1cc(NC(=O)c2ccc3c(c2)CCN3C(C)=O)cc(OC)c1
InChIInChI=1S/C19H20N2O4/c1-12(22)21-7-6-13-8-14(4-5-18(13)21)19(23)20-15-9-16(24-2)11-17(10-15)25-3/h4-5,8-11H,6-7H2,1-3H3,(H,20,23)
InChIKeyXHSFAYKJMMMWMS-UHFFFAOYSA-N
XLogP2.87
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide 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

1-acetyl-N-(3,4,5-trimethoxyphenyl)-2,3-dihydroindole-5-carboxamide
CID 34258783
N-(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)-3,5-dimethoxybenzamide
CID 7656241
1-[1-(3,5-dimethoxybenzoyl)-2,3-dihydroindol-5-yl]ethanone
CID 110737350
2-[4-[(1-acetyl-2,3-dihydroindole-5-carbonyl)amino]phenyl]-2-methylpropanoic acid
CID 119254151
N-(1-acetyl-2,3-dihydroindol-5-yl)-4-butoxybenzamide
CID 42423988
1-acetyl-N-ethoxy-2,3-dihydroindole-5-carboxamide
CID 43048030
3-[(1-acetyl-2,3-dihydroindole-5-carbonyl)amino]-3-(4-methoxyphenyl)propanoic acid
CID 45342349
3-[4-[(1-acetyl-2,3-dihydroindole-5-carbonyl)amino]phenyl]-2-methylpropanoic acid
CID 120541330
N-(1-acetyl-2,3-dihydroindol-5-yl)-4-prop-2-enoxybenzamide
CID 39628262
1-acetyl-N-(2,3-dimethylphenyl)-2,3-dihydroindole-5-carboxamide
CID 29284026
1-acetyl-N-(2-carbamoylphenyl)-2,3-dihydroindole-5-carboxamide
CID 51266821
1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide
CID 78859744

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide?
The IUPAC name of 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide (CID 51265763) is 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide.
What is the SMILES notation for 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide?
The canonical SMILES for 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide is COc1cc(NC(=O)c2ccc3c(c2)CCN3C(C)=O)cc(OC)c1.
What is the InChIKey of 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide?
The InChIKey is XHSFAYKJMMMWMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-12(22)21-7-6-13-8-14(4-5-18(13)21)19(23)20-15-9-16(24-2)11-17(10-15)25-3/h4-5,8-11H,6-7H2,1-3H3,(H,20,23).
What are the key properties of 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide?
1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide has a molecular weight of 340.38 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 51265763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).