N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide

C20H22N2O3 — CID 53099278

IUPACN-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide
SMILESCCC(=O)NCc1ccc2c(c1)N(C(=O)c1ccc(OC)cc1)CC2
InChIInChI=1S/C20H22N2O3/c1-3-19(23)21-13-14-4-5-15-10-11-22(18(15)12-14)20(24)16-6-8-17(25-2)9-7-16/h4-9,12H,3,10-11,13H2,1-2H3,(H,21,23)
InChIKeyFKCXXOCEBDCJMD-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.92
Rot. Bonds5

About N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide

N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide (PubChem CID 53099278) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide.

Molecular Properties

Compound NameN-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide
PubChem CID53099278
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide
SMILESCCC(=O)NCc1ccc2c(c1)N(C(=O)c1ccc(OC)cc1)CC2
InChIInChI=1S/C20H22N2O3/c1-3-19(23)21-13-14-4-5-15-10-11-22(18(15)12-14)20(24)16-6-8-17(25-2)9-7-16/h4-9,12H,3,10-11,13H2,1-2H3,(H,21,23)
InChIKeyFKCXXOCEBDCJMD-UHFFFAOYSA-N
XLogP2.92
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide 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

2-(3,4-dimethoxyphenyl)-N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]acetamide
CID 53099252
3,5-dimethoxy-N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]benzamide
CID 53099251
2-cyclopentyl-N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]acetamide
CID 53099268
ethyl (2S)-2-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methylcarbamoylamino]propanoate
CID 95081927
1-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]-3-(3-methoxyphenyl)urea
CID 53099631
1-(2,4-dimethoxyphenyl)-3-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]urea
CID 53099677
1-(4-methoxybenzoyl)-N-methyl-2,3-dihydroindole-6-carboxamide
CID 53160326
1-(4-methoxyphenyl)-3-[[1-(3-methylbenzoyl)-2,3-dihydroindol-6-yl]methyl]urea
CID 53099728
1-[[1-(4-methylbenzoyl)-2,3-dihydroindol-6-yl]methyl]-3-propan-2-ylurea
CID 53099492
1-(4-methoxybenzoyl)-N-(4-methoxyphenyl)-2,3-dihydroindole-6-carboxamide
CID 53160317
1-[[4-(6-methoxy-2,3-dihydroindole-1-carbonyl)phenyl]methyl]pyrrolidine-2,5-dione
CID 167792230
1-(difluoromethyl)-N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]-5-methylpyrazole-4-sulfonamide
CID 53102493

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide?
The IUPAC name of N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide (CID 53099278) is N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide.
What is the SMILES notation for N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide?
The canonical SMILES for N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide is CCC(=O)NCc1ccc2c(c1)N(C(=O)c1ccc(OC)cc1)CC2.
What is the InChIKey of N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide?
The InChIKey is FKCXXOCEBDCJMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-3-19(23)21-13-14-4-5-15-10-11-22(18(15)12-14)20(24)16-6-8-17(25-2)9-7-16/h4-9,12H,3,10-11,13H2,1-2H3,(H,21,23).
What are the key properties of N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide?
N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide has a molecular weight of 338.41 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-methoxybenzoyl)-2,3-dihydroindol-6-yl]methyl]propanamide is sourced from PubChem (CID 53099278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).