N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide

C23H29N3O5S — CID 25205058

IUPACN-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide
SMILESCS(=O)(=O)c1ccc(-n2ccc(OC3CCN(C(=O)NC4CCCC4)CC3)cc2=O)cc1
InChIInChI=1S/C23H29N3O5S/c1-32(29,30)21-8-6-18(7-9-21)26-15-12-20(16-22(26)27)31-19-10-13-25(14-11-19)23(28)24-17-4-2-3-5-17/h6-9,12,15-17,19H,2-5,10-11,13-14H2,1H3,(H,24,28)
InChIKeyXOPVPGQILGVHPN-UHFFFAOYSA-N
MW459.57 g/mol
LogP2.74
Rot. Bonds5

About N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide

N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide (PubChem CID 25205058) has the molecular formula C23H29N3O5S and a molecular weight of 459.57 g/mol. Its IUPAC name is N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide
PubChem CID25205058
Molecular FormulaC23H29N3O5S
Molecular Weight459.57 g/mol
Exact Mass459.18
IUPAC NameN-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide
SMILESCS(=O)(=O)c1ccc(-n2ccc(OC3CCN(C(=O)NC4CCCC4)CC3)cc2=O)cc1
InChIInChI=1S/C23H29N3O5S/c1-32(29,30)21-8-6-18(7-9-21)26-15-12-20(16-22(26)27)31-19-10-13-25(14-11-19)23(28)24-17-4-2-3-5-17/h6-9,12,15-17,19H,2-5,10-11,13-14H2,1H3,(H,24,28)
InChIKeyXOPVPGQILGVHPN-UHFFFAOYSA-N
XLogP2.74
TPSA97.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500459.57
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide with MolForge

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Related Compounds

4-(1-benzoylpiperidin-4-yl)oxy-1-(4-methylsulfonylphenyl)pyridin-2-one
CID 25204715
4-[1-(3-methylbutanoyl)piperidin-4-yl]oxy-1-(4-methylsulfonylphenyl)pyridin-2-one
CID 25204781
4-(4-acetylcyclohexyl)oxy-1-(4-methylsulfonylphenyl)pyridin-2-one
CID 58458108
cyclohexa-1,5-dien-1-yl 4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxylate
CID 143747954
4-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-1-(4-methylsulfonylphenyl)pyridin-2-one
CID 25204037
4-(8-azabicyclo[3.2.1]octan-3-yloxy)-1-(4-methylsulfonylphenyl)pyridin-2-one
CID 67367085
4-[[1-(4-methoxyphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxylic acid
CID 57468346
2-(4-tert-butylphenyl)-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxylic acid
CID 67414911
4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]-2-(4-propan-2-ylphenyl)piperidine-1-carboxylic acid
CID 67415567
2-(2-chlorophenyl)-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxylic acid
CID 67413426
N-cyclohexyl-4-(2-methyl-5-methylsulfonylbenzoyl)piperazine-1-carboxamide
CID 55558241
4-(4-methylsulfonylphenoxy)piperidine-1-carboxamide
CID 71166636

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide (CID 25205058) is N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide is CS(=O)(=O)c1ccc(-n2ccc(OC3CCN(C(=O)NC4CCCC4)CC3)cc2=O)cc1.
What is the InChIKey of N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide?
The InChIKey is XOPVPGQILGVHPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O5S/c1-32(29,30)21-8-6-18(7-9-21)26-15-12-20(16-22(26)27)31-19-10-13-25(14-11-19)23(28)24-17-4-2-3-5-17/h6-9,12,15-17,19H,2-5,10-11,13-14H2,1H3,(H,24,28).
What are the key properties of N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide?
N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide has a molecular weight of 459.57 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxamide is sourced from PubChem (CID 25205058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).