6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide

C20H24N2O3 — CID 124906857

IUPAC6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide
SMILESCc1ccc2[nH]c(=O)cc(C(=O)N[C@@H]3COC4(CCCCC4)C3)c2c1
InChIInChI=1S/C20H24N2O3/c1-13-5-6-17-15(9-13)16(10-18(23)22-17)19(24)21-14-11-20(25-12-14)7-3-2-4-8-20/h5-6,9-10,14H,2-4,7-8,11-12H2,1H3,(H,21,24)(H,22,23)/t14-/m0/s1
InChIKeySCJOPGMQMSEYQX-AWEZNQCLSA-N
MW340.42 g/mol
LogP3.06
Rot. Bonds2

About 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide

6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 124906857) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide
PubChem CID124906857
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide
SMILESCc1ccc2[nH]c(=O)cc(C(=O)N[C@@H]3COC4(CCCCC4)C3)c2c1
InChIInChI=1S/C20H24N2O3/c1-13-5-6-17-15(9-13)16(10-18(23)22-17)19(24)21-14-11-20(25-12-14)7-3-2-4-8-20/h5-6,9-10,14H,2-4,7-8,11-12H2,1H3,(H,21,24)(H,22,23)/t14-/m0/s1
InChIKeySCJOPGMQMSEYQX-AWEZNQCLSA-N
XLogP3.06
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide with MolForge

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Related Compounds

6-methyl-N-[(3R)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide
CID 124906860
N-[1-(cyclohexylmethyl)-5-oxopyrrolidin-3-yl]-6-methyl-2-oxo-1H-quinoline-4-carboxamide
CID 56886408
6-methyl-2-oxo-N-[(6R)-4,5,6,7-tetrahydro-1H-indazol-6-yl]-1H-quinoline-4-carboxamide
CID 126433679
6-methyl-2-oxo-N-(oxolan-3-ylmethyl)-1H-quinoline-4-carboxamide
CID 121499260
N-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1H-quinoline-4-carboxamide
CID 10086797
6-methyl-4-(3-oxa-9-azaspiro[5.5]undecane-9-carbonyl)-1H-quinolin-2-one
CID 121499593
6-methyl-N-(1-oxaspiro[4.5]decan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 118775695
N-(1-oxaspiro[4.5]decan-3-yl)pyridine-4-carboxamide
CID 91767897
N-(1-oxaspiro[4.5]decan-3-yl)-6-oxo-2-pyridin-2-yl-1H-pyrimidine-5-carboxamide
CID 70752204
2-morpholin-4-yl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]benzamide
CID 125165608
N-cyclohexyl-6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxamide
CID 7872467
2-methyl-N-[(3S)-1-oxaspiro[4.4]nonan-3-yl]-1-benzofuran-5-carboxamide
CID 97145621

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide (CID 124906857) is 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide is Cc1ccc2[nH]c(=O)cc(C(=O)N[C@@H]3COC4(CCCCC4)C3)c2c1.
What is the InChIKey of 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is SCJOPGMQMSEYQX-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-13-5-6-17-15(9-13)16(10-18(23)22-17)19(24)21-14-11-20(25-12-14)7-3-2-4-8-20/h5-6,9-10,14H,2-4,7-8,11-12H2,1H3,(H,21,24)(H,22,23)/t14-/m0/s1.
What are the key properties of 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide?
6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 340.42 g/mol, XLogP of 3.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(3S)-1-oxaspiro[4.5]decan-3-yl]-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 124906857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).