N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide

C15H23N3O2S — CID 57065393

IUPACN-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide
SMILESO=S(=O)(NC1CCCCN1CC1CCC1)c1cccnc1
InChIInChI=1S/C15H23N3O2S/c19-21(20,14-7-4-9-16-11-14)17-15-8-1-2-10-18(15)12-13-5-3-6-13/h4,7,9,11,13,15,17H,1-3,5-6,8,10,12H2
InChIKeyYJMZMCRRYZQVRU-UHFFFAOYSA-N
MW309.43 g/mol
LogP1.97
Rot. Bonds5

About N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide

N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide (PubChem CID 57065393) has the molecular formula C15H23N3O2S and a molecular weight of 309.43 g/mol. Its IUPAC name is N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide
PubChem CID57065393
Molecular FormulaC15H23N3O2S
Molecular Weight309.43 g/mol
Exact Mass309.15
IUPAC NameN-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide
SMILESO=S(=O)(NC1CCCCN1CC1CCC1)c1cccnc1
InChIInChI=1S/C15H23N3O2S/c19-21(20,14-7-4-9-16-11-14)17-15-8-1-2-10-18(15)12-13-5-3-6-13/h4,7,9,11,13,15,17H,1-3,5-6,8,10,12H2
InChIKeyYJMZMCRRYZQVRU-UHFFFAOYSA-N
XLogP1.97
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.43
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclobutylmethyl)pyridine-3-sulfonamide
CID 47331342
N-(2-aminocyclopentyl)pyridine-3-sulfonamide
CID 63252124
N-[(3-hydroxycyclohexyl)methyl]pyridine-3-sulfonamide
CID 113318540
3-(pyridin-3-ylsulfonylamino)cyclohexane-1-carboxylic acid
CID 55145962
N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 47331340
N-(3-aminocyclobutyl)pyridine-3-sulfonamide
CID 43597835
N-pyrrolidin-3-ylpyridine-3-sulfonamide
CID 62380285
N-(cyclobutylmethyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide
CID 38653049
N-[5-(cyclohexylmethyl)-1,3,4-thiadiazol-2-yl]pyridine-3-sulfonamide
CID 71859525
N-(6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 63662802
4-N-cyclohexyl-1-N-(pyridin-3-ylmethyl)benzene-1,4-disulfonamide
CID 3769450
N-(1-methyl-6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 131898317

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide?
The IUPAC name of N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide (CID 57065393) is N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide is O=S(=O)(NC1CCCCN1CC1CCC1)c1cccnc1.
What is the InChIKey of N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide?
The InChIKey is YJMZMCRRYZQVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2S/c19-21(20,14-7-4-9-16-11-14)17-15-8-1-2-10-18(15)12-13-5-3-6-13/h4,7,9,11,13,15,17H,1-3,5-6,8,10,12H2.
What are the key properties of N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide?
N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide has a molecular weight of 309.43 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclobutylmethyl)piperidin-2-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 57065393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).