N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide

C16H18N2O2 — CID 110390059

IUPACN-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
SMILESCc1cc2cc(CCC(=O)NC3CC3)ccc2[nH]c1=O
InChIInChI=1S/C16H18N2O2/c1-10-8-12-9-11(2-6-14(12)18-16(10)20)3-7-15(19)17-13-4-5-13/h2,6,8-9,13H,3-5,7H2,1H3,(H,17,19)(H,18,20)
InChIKeyXGZSMECNMDCBTC-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.05
Rot. Bonds4

About N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide

N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide (PubChem CID 110390059) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
PubChem CID110390059
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
SMILESCc1cc2cc(CCC(=O)NC3CC3)ccc2[nH]c1=O
InChIInChI=1S/C16H18N2O2/c1-10-8-12-9-11(2-6-14(12)18-16(10)20)3-7-15(19)17-13-4-5-13/h2,6,8-9,13H,3-5,7H2,1H3,(H,17,19)(H,18,20)
InChIKeyXGZSMECNMDCBTC-UHFFFAOYSA-N
XLogP2.05
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cycloheptyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390127
6-[2-(cyclopropylamino)ethyl]-3-methyl-1H-quinolin-2-one
CID 116997530
N-(4-fluorophenyl)-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390148
3-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-(2-methylphenyl)propanamide
CID 110390135
N-(2,3-dimethylphenyl)-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390145
3-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(3-methylphenyl)methyl]propanamide
CID 110390084
N-(3-fluorophenyl)-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390165
3-methyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H-quinolin-2-one
CID 110390077
N-(3-cyanophenyl)-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390170
N-tert-butyl-3-(3-methyl-2-oxo-1H-quinolin-7-yl)propanamide
CID 110390011
N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]cyclohexanecarboxamide
CID 110666063
N-cyclopropyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331054

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide?
The IUPAC name of N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide (CID 110390059) is N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide is Cc1cc2cc(CCC(=O)NC3CC3)ccc2[nH]c1=O.
What is the InChIKey of N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide?
The InChIKey is XGZSMECNMDCBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-10-8-12-9-11(2-6-14(12)18-16(10)20)3-7-15(19)17-13-4-5-13/h2,6,8-9,13H,3-5,7H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide?
N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide has a molecular weight of 270.33 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide is sourced from PubChem (CID 110390059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).