1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide

C16H20N2O3 — CID 167985111

IUPAC1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide
SMILESNC(=O)c1ccc2c(c1)CCCN2C(=O)CC1CCCO1
InChIInChI=1S/C16H20N2O3/c17-16(20)12-5-6-14-11(9-12)3-1-7-18(14)15(19)10-13-4-2-8-21-13/h5-6,9,13H,1-4,7-8,10H2,(H2,17,20)
InChIKeyVQZFTOZPENXLCM-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.63
Rot. Bonds3

About 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide

1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide (PubChem CID 167985111) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide.

Molecular Properties

Compound Name1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide
PubChem CID167985111
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide
SMILESNC(=O)c1ccc2c(c1)CCCN2C(=O)CC1CCCO1
InChIInChI=1S/C16H20N2O3/c17-16(20)12-5-6-14-11(9-12)3-1-7-18(14)15(19)10-13-4-2-8-21-13/h5-6,9,13H,1-4,7-8,10H2,(H2,17,20)
InChIKeyVQZFTOZPENXLCM-UHFFFAOYSA-N
XLogP1.63
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide
CID 75457317
1-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-2-cyclobutylethanone
CID 103161499
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[(2R)-oxolan-2-yl]methylamino]ethanone
CID 1439765
1-(5-amino-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-2-(oxolan-2-yl)ethanone
CID 114335682
1-(5-amino-2,3-dihydroindol-1-yl)-3-(oxan-2-yl)propan-1-one
CID 63952299
1-(2-cyclopentylacetyl)-2,3-dihydroindole-5-carboxylic acid
CID 45349399
2-[2-(oxan-2-yl)acetyl]-1,3-dihydroisoindole-5-carboxylic acid
CID 103997329
1-(6-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-3-(oxolan-2-ylmethoxy)propan-1-one
CID 55872668
[2-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] 4-(oxolan-2-ylmethoxy)benzoate
CID 24526528
3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxo-N-(oxolan-2-ylmethyl)propanamide
CID 108943685
1-(3-methylbenzoyl)-N-[[(2R)-oxolan-2-yl]methyl]-3,4-dihydro-2H-quinoline-6-carboxamide
CID 94086752
N,N-dimethyl-1-[2-(oxolan-2-yl)acetyl]-2,3-dihydroindole-6-sulfonamide
CID 56805828

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide?
The IUPAC name of 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide (CID 167985111) is 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide.
What is the SMILES notation for 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide?
The canonical SMILES for 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide is NC(=O)c1ccc2c(c1)CCCN2C(=O)CC1CCCO1.
What is the InChIKey of 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide?
The InChIKey is VQZFTOZPENXLCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c17-16(20)12-5-6-14-11(9-12)3-1-7-18(14)15(19)10-13-4-2-8-21-13/h5-6,9,13H,1-4,7-8,10H2,(H2,17,20).
What are the key properties of 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide?
1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxolan-2-yl)acetyl]-3,4-dihydro-2H-quinoline-6-carboxamide is sourced from PubChem (CID 167985111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).