1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone

C20H21N3O2 — CID 112532251

IUPAC1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone
SMILESCC(=O)N1CCc2c(cncc2C(=O)N2c3ccccc3CC2C)C1
InChIInChI=1S/C20H21N3O2/c1-13-9-15-5-3-4-6-19(15)23(13)20(25)18-11-21-10-16-12-22(14(2)24)8-7-17(16)18/h3-6,10-11,13H,7-9,12H2,1-2H3
InChIKeyKEPWLIBLZJKDSO-UHFFFAOYSA-N
MW335.41 g/mol
LogP2.58
Rot. Bonds1

About 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone

1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone (PubChem CID 112532251) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone.

Molecular Properties

Compound Name1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone
PubChem CID112532251
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone
SMILESCC(=O)N1CCc2c(cncc2C(=O)N2c3ccccc3CC2C)C1
InChIInChI=1S/C20H21N3O2/c1-13-9-15-5-3-4-6-19(15)23(13)20(25)18-11-21-10-16-12-22(14(2)24)8-7-17(16)18/h3-6,10-11,13H,7-9,12H2,1-2H3
InChIKeyKEPWLIBLZJKDSO-UHFFFAOYSA-N
XLogP2.58
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone with MolForge

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Related Compounds

1-[5-(3-aminopyrrolidine-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone
CID 112530798
1-[5-[4-(hydroxymethyl)piperidine-1-carbonyl]-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone
CID 112531749
(2-methyl-2,3-dihydroindol-1-yl)-(3-methyl-4-pyridinyl)methanone
CID 110863904
(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130
6-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxylic acid
CID 43427178
[6-(ethylamino)-3-pyridinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 62172788
[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109162500
1-[5-(4-amino-2-methylindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone
CID 112526485
1-[5-(7-aminoindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone
CID 112526635
N-[4-[[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide
CID 109164561
7-acetyl-N-(4-methylphenyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide
CID 112521061
[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 62173307

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone?
The IUPAC name of 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone (CID 112532251) is 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone.
What is the SMILES notation for 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone?
The canonical SMILES for 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone is CC(=O)N1CCc2c(cncc2C(=O)N2c3ccccc3CC2C)C1.
What is the InChIKey of 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone?
The InChIKey is KEPWLIBLZJKDSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-13-9-15-5-3-4-6-19(15)23(13)20(25)18-11-21-10-16-12-22(14(2)24)8-7-17(16)18/h3-6,10-11,13H,7-9,12H2,1-2H3.
What are the key properties of 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone?
1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone has a molecular weight of 335.41 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]ethanone is sourced from PubChem (CID 112532251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).