N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide

C11H16N2O3S — CID 43629295

IUPACN-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)NCC2CCCC2)c[nH]1
InChIInChI=1S/C11H16N2O3S/c14-11-6-5-10(8-12-11)17(15,16)13-7-9-3-1-2-4-9/h5-6,8-9,13H,1-4,7H2,(H,12,14)
InChIKeyXDPZRPFQDJSBQG-UHFFFAOYSA-N
MW256.33 g/mol
LogP0.84
Rot. Bonds4

About N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide

N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 43629295) has the molecular formula C11H16N2O3S and a molecular weight of 256.33 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID43629295
Molecular FormulaC11H16N2O3S
Molecular Weight256.33 g/mol
Exact Mass256.09
IUPAC NameN-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)NCC2CCCC2)c[nH]1
InChIInChI=1S/C11H16N2O3S/c14-11-6-5-10(8-12-11)17(15,16)13-7-9-3-1-2-4-9/h5-6,8-9,13H,1-4,7H2,(H,12,14)
InChIKeyXDPZRPFQDJSBQG-UHFFFAOYSA-N
XLogP0.84
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclobutylmethyl)-2-oxo-1H-pyridine-4-sulfonamide
CID 154450587
5-(4-methylpiperidin-1-yl)sulfonyl-1H-pyridin-2-one
CID 43629028
N-Cyclopentyl-6-oxo-1,6-dihydropyridine-3-sulfonamide
CID 43629042
5-(3-methylpiperidin-1-yl)sulfonyl-1H-pyridin-2-one
CID 43629050
6-oxo-N-pentyl-1H-pyridine-3-sulfonamide
CID 43629076
N-(3-methylbutyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629122
N-(4-methylcyclohexyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629181
N-(2-methylcyclohexyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629208
5-(3,5-dimethylpiperidin-1-yl)sulfonyl-1H-pyridin-2-one
CID 43629223
N-cyclopentyl-N-methyl-6-oxo-1H-pyridine-3-sulfonamide
CID 43629279
N-methyl-6-oxo-N-pentyl-1H-pyridine-3-sulfonamide
CID 43629288
N-methyl-N-(2-methylbutyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629289

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide (CID 43629295) is N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide is O=c1ccc(S(=O)(=O)NCC2CCCC2)c[nH]1.
What is the InChIKey of N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is XDPZRPFQDJSBQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3S/c14-11-6-5-10(8-12-11)17(15,16)13-7-9-3-1-2-4-9/h5-6,8-9,13H,1-4,7H2,(H,12,14).
What are the key properties of N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide?
N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 256.33 g/mol, XLogP of 0.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 43629295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).