(2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide

C20H22N2O2 — CID 2128245

IUPAC(2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide
SMILESCC(=O)c1ccc(NC(=O)[C@@H](C)N2c3ccccc3C[C@H]2C)cc1
InChIInChI=1S/C20H22N2O2/c1-13-12-17-6-4-5-7-19(17)22(13)14(2)20(24)21-18-10-8-16(9-11-18)15(3)23/h4-11,13-14H,12H2,1-3H3,(H,21,24)/t13-,14-/m1/s1
InChIKeyVSJVXQVKLHQJER-ZIAGYGMSSA-N
MW322.41 g/mol
LogP3.67
Rot. Bonds4

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

(2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide (PubChem CID 2128245) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide
PubChem CID2128245
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name(2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide
SMILESCC(=O)c1ccc(NC(=O)[C@@H](C)N2c3ccccc3C[C@H]2C)cc1
InChIInChI=1S/C20H22N2O2/c1-13-12-17-6-4-5-7-19(17)22(13)14(2)20(24)21-18-10-8-16(9-11-18)15(3)23/h4-11,13-14H,12H2,1-3H3,(H,21,24)/t13-,14-/m1/s1
InChIKeyVSJVXQVKLHQJER-ZIAGYGMSSA-N
XLogP3.67
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoacetamide
CID 108514855
N-(4-acetylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxamide
CID 109270109
1-[4-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]-3-propan-2-ylurea
CID 71889672
(2R)-N-(4-acetylphenyl)-2-(1,3-dioxoisoindol-2-yl)propanamide
CID 721438
N-(4-acetylphenyl)-6-methyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109337849
2-methyl-N-(4-propan-2-ylphenyl)-2,3-dihydroindole-1-carboxamide
CID 108991651
1-[4-(2-methyl-2,3-dihydroindol-1-yl)phenyl]-3-phenylurea
CID 112989569
N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)propanamide
CID 4825469
[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 62173307
(2R)-N-(4-acetylphenyl)-2-phenylsulfanylpropanamide
CID 2501504
methyl 2,4-dimethyl-5-[(2S)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]propanoyl]-1H-pyrrole-3-carboxylate
CID 7042363
4-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]benzamide
CID 4818217

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide?
The IUPAC name of (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide (CID 2128245) is (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide.
What is the SMILES notation for (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide?
The canonical SMILES for (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide is CC(=O)c1ccc(NC(=O)[C@@H](C)N2c3ccccc3C[C@H]2C)cc1.
What is the InChIKey of (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide?
The InChIKey is VSJVXQVKLHQJER-ZIAGYGMSSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-13-12-17-6-4-5-7-19(17)22(13)14(2)20(24)21-18-10-8-16(9-11-18)15(3)23/h4-11,13-14H,12H2,1-3H3,(H,21,24)/t13-,14-/m1/s1.
What are the key properties of (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide?
(2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide has a molecular weight of 322.41 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-acetylphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]propanamide is sourced from PubChem (CID 2128245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).