7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane

C18H23ClN2O3 — CID 142970241

IUPAC7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane
SMILESCC1(NC(=O)c2cc3ccc(Cl)cc3[nH]c2=O)CCCC1.COC
InChIInChI=1S/C16H17ClN2O2.C2H6O/c1-16(6-2-3-7-16)19-15(21)12-8-10-4-5-11(17)9-13(10)18-14(12)20;1-3-2/h4-5,8-9H,2-3,6-7H2,1H3,(H,18,20)(H,19,21);1-2H3
InChIKeyZBSAMJJOZVIDTC-UHFFFAOYSA-N
MW350.85 g/mol
LogP3.51
Rot. Bonds2

About 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane

7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane (PubChem CID 142970241) has the molecular formula C18H23ClN2O3 and a molecular weight of 350.85 g/mol. Its IUPAC name is 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane.

Molecular Properties

Compound Name7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane
PubChem CID142970241
Molecular FormulaC18H23ClN2O3
Molecular Weight350.85 g/mol
Exact Mass350.14
IUPAC Name7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane
SMILESCC1(NC(=O)c2cc3ccc(Cl)cc3[nH]c2=O)CCCC1.COC
InChIInChI=1S/C16H17ClN2O2.C2H6O/c1-16(6-2-3-7-16)19-15(21)12-8-10-4-5-11(17)9-13(10)18-14(12)20;1-3-2/h4-5,8-9H,2-3,6-7H2,1H3,(H,18,20)(H,19,21);1-2H3
InChIKeyZBSAMJJOZVIDTC-UHFFFAOYSA-N
XLogP3.51
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.85
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-2-hydroxy-N-(1-methylcyclohexyl)benzamide
CID 61217012
7-chloro-3-[2-(4-methoxyphenyl)acetyl]-1H-quinolin-2-one
CID 12002170
2,4-dichloro-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120567340
5-chloro-N-(1-methylcyclohexyl)-2-nitrobenzamide
CID 61216845
7-chloro-3-[(Z)-3-(4-methoxyphenyl)prop-2-enoyl]-1H-quinolin-2-one
CID 67007557
5-chloro-2-iodo-N-(1-methylcyclopropyl)benzamide
CID 103677274
2-bromo-4-chloro-N-(1-methylcyclopropyl)benzamide
CID 103765307
4-amino-2-chloro-N-(1-methylcyclohexyl)benzamide;hydrochloride
CID 119736471
4-chloro-6-methyl-N-(1-methylcyclopentyl)pyridine-3-carboxamide
CID 81226891
5-chloro-2-methyl-N-(3-methylpyrrolidin-3-yl)benzamide
CID 107423069
4-chloro-2-hydroxy-N-(4-methyloxan-4-yl)benzamide
CID 115761034
(7-chloro-2-oxo-1H-quinolin-3-yl)phosphonic acid
CID 10945159

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane?
The IUPAC name of 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane (CID 142970241) is 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane.
What is the SMILES notation for 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane?
The canonical SMILES for 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane is CC1(NC(=O)c2cc3ccc(Cl)cc3[nH]c2=O)CCCC1.COC.
What is the InChIKey of 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane?
The InChIKey is ZBSAMJJOZVIDTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2.C2H6O/c1-16(6-2-3-7-16)19-15(21)12-8-10-4-5-11(17)9-13(10)18-14(12)20;1-3-2/h4-5,8-9H,2-3,6-7H2,1H3,(H,18,20)(H,19,21);1-2H3.
What are the key properties of 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane?
7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane has a molecular weight of 350.85 g/mol, XLogP of 3.51, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(1-methylcyclopentyl)-2-oxo-1H-quinoline-3-carboxamide;methoxymethane is sourced from PubChem (CID 142970241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).