2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one

C22H24N4O2 — CID 170281880

IUPAC2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one
SMILESCN(CC(=O)N1CCCc2ccccc21)Cc1nc2ccccc2c(=O)n1C
InChIInChI=1S/C22H24N4O2/c1-24(14-20-23-18-11-5-4-10-17(18)22(28)25(20)2)15-21(27)26-13-7-9-16-8-3-6-12-19(16)26/h3-6,8,10-12H,7,9,13-15H2,1-2H3
InChIKeyFFGRBPBRJCPIEL-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.34
Rot. Bonds4

About 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one

2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one (PubChem CID 170281880) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one.

Molecular Properties

Compound Name2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one
PubChem CID170281880
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one
SMILESCN(CC(=O)N1CCCc2ccccc21)Cc1nc2ccccc2c(=O)n1C
InChIInChI=1S/C22H24N4O2/c1-24(14-20-23-18-11-5-4-10-17(18)22(28)25(20)2)15-21(27)26-13-7-9-16-8-3-6-12-19(16)26/h3-6,8,10-12H,7,9,13-15H2,1-2H3
InChIKeyFFGRBPBRJCPIEL-UHFFFAOYSA-N
XLogP2.34
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one with MolForge

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Related Compounds

3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-ethylquinazolin-4-one
CID 860000
2-[cyclohexyl(methyl)amino]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 54817931
N-butan-2-yl-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]acetamide
CID 113159104
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[methyl-[(1R)-1-phenylethyl]amino]ethanone
CID 68964307
N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-N-propylacetamide
CID 113157998
1-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-3-methylbenzimidazol-2-one
CID 16590199
2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-3-(3-methoxyphenyl)quinazolin-4-one
CID 16533100
1-(3,4-dihydro-2H-quinolin-1-yl)-2-naphthalen-1-ylethanone
CID 1226597
N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-N-[2-(dimethylamino)ethyl]methanesulfonamide
CID 113149853
3-methyl-2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]quinazolin-4-one
CID 122133317
2-[cyclopropyl-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]amino]acetic acid
CID 60834511
5,5-bis[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
CID 2101977

Frequently Asked Questions

What is the IUPAC name of 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one?
The IUPAC name of 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one (CID 170281880) is 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one.
What is the SMILES notation for 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one?
The canonical SMILES for 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one is CN(CC(=O)N1CCCc2ccccc21)Cc1nc2ccccc2c(=O)n1C.
What is the InChIKey of 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one?
The InChIKey is FFGRBPBRJCPIEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-24(14-20-23-18-11-5-4-10-17(18)22(28)25(20)2)15-21(27)26-13-7-9-16-8-3-6-12-19(16)26/h3-6,8,10-12H,7,9,13-15H2,1-2H3.
What are the key properties of 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one?
2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one has a molecular weight of 376.46 g/mol, XLogP of 2.34, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-methylamino]methyl]-3-methylquinazolin-4-one is sourced from PubChem (CID 170281880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).