6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one

C19H18N2O2 — CID 51648692

IUPAC6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one
SMILESC[C@H]1Cc2ccccc2N1C(=O)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C19H18N2O2/c1-12-10-14-4-2-3-5-17(14)21(12)19(23)15-6-8-16-13(11-15)7-9-18(22)20-16/h2-6,8,11-12H,7,9-10H2,1H3,(H,20,22)/t12-/m0/s1
InChIKeyKMBACELNJZAWOM-LBPRGKRZSA-N
MW306.37 g/mol
LogP3.16
Rot. Bonds1

About 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one

6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 51648692) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one
PubChem CID51648692
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one
SMILESC[C@H]1Cc2ccccc2N1C(=O)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C19H18N2O2/c1-12-10-14-4-2-3-5-17(14)21(12)19(23)15-6-8-16-13(11-15)7-9-18(22)20-16/h2-6,8,11-12H,7,9-10H2,1H3,(H,20,22)/t12-/m0/s1
InChIKeyKMBACELNJZAWOM-LBPRGKRZSA-N
XLogP3.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one (CID 51648692) is 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one is C[C@H]1Cc2ccccc2N1C(=O)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is KMBACELNJZAWOM-LBPRGKRZSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-12-10-14-4-2-3-5-17(14)21(12)19(23)15-6-8-16-13(11-15)7-9-18(22)20-16/h2-6,8,11-12H,7,9-10H2,1H3,(H,20,22)/t12-/m0/s1.
What are the key properties of 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one?
6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 306.37 g/mol, XLogP of 3.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 51648692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).