(2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide

C17H17ClN2O — CID 8704432

IUPAC(2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
SMILESC[C@H](C(=O)Nc1cccc(Cl)c1)N1CCc2ccccc21
InChIInChI=1S/C17H17ClN2O/c1-12(17(21)19-15-7-4-6-14(18)11-15)20-10-9-13-5-2-3-8-16(13)20/h2-8,11-12H,9-10H2,1H3,(H,19,21)/t12-/m1/s1
InChIKeyNUTOFQNABFGIMF-GFCCVEGCSA-N
MW300.79 g/mol
LogP3.73
Rot. Bonds3

About (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide

(2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide (PubChem CID 8704432) has the molecular formula C17H17ClN2O and a molecular weight of 300.79 g/mol. Its IUPAC name is (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide.

Molecular Properties

Compound Name(2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
PubChem CID8704432
Molecular FormulaC17H17ClN2O
Molecular Weight300.79 g/mol
Exact Mass300.10
IUPAC Name(2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
SMILESC[C@H](C(=O)Nc1cccc(Cl)c1)N1CCc2ccccc21
InChIInChI=1S/C17H17ClN2O/c1-12(17(21)19-15-7-4-6-14(18)11-15)20-10-9-13-5-2-3-8-16(13)20/h2-8,11-12H,9-10H2,1H3,(H,19,21)/t12-/m1/s1
InChIKeyNUTOFQNABFGIMF-GFCCVEGCSA-N
XLogP3.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide?
The IUPAC name of (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide (CID 8704432) is (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide.
What is the SMILES notation for (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide?
The canonical SMILES for (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide is C[C@H](C(=O)Nc1cccc(Cl)c1)N1CCc2ccccc21.
What is the InChIKey of (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide?
The InChIKey is NUTOFQNABFGIMF-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H17ClN2O/c1-12(17(21)19-15-7-4-6-14(18)11-15)20-10-9-13-5-2-3-8-16(13)20/h2-8,11-12H,9-10H2,1H3,(H,19,21)/t12-/m1/s1.
What are the key properties of (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide?
(2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide has a molecular weight of 300.79 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide is sourced from PubChem (CID 8704432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).