N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide

C16H23N3O3S — CID 6460433

IUPACN-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCC1
InChIInChI=1S/C16H23N3O3S/c20-16(18-10-2-1-3-11-18)17-14-6-8-15(9-7-14)23(21,22)19-12-4-5-13-19/h6-9H,1-5,10-13H2,(H,17,20)
InChIKeyLZCZWVKJHOOIRF-UHFFFAOYSA-N
MW337.44 g/mol
LogP2.49
Rot. Bonds3

About N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide

N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide (PubChem CID 6460433) has the molecular formula C16H23N3O3S and a molecular weight of 337.44 g/mol. Its IUPAC name is N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide
PubChem CID6460433
Molecular FormulaC16H23N3O3S
Molecular Weight337.44 g/mol
Exact Mass337.15
IUPAC NameN-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCC1
InChIInChI=1S/C16H23N3O3S/c20-16(18-10-2-1-3-11-18)17-14-6-8-15(9-7-14)23(21,22)19-12-4-5-13-19/h6-9H,1-5,10-13H2,(H,17,20)
InChIKeyLZCZWVKJHOOIRF-UHFFFAOYSA-N
XLogP2.49
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.44
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-sulfamoylphenyl)azocane-1-carboxamide
CID 17414007
N-(4-piperidin-1-ylsulfonylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide
CID 20628894
1-N,4-N-bis[4-(azepan-1-ylsulfonyl)phenyl]benzene-1,4-dicarboxamide
CID 5167539
3-(methanesulfonamido)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide
CID 47038794
4-pyrrolidin-1-ylsulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 26252425
1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-chlorophenyl)urea
CID 1011433
N-(4-piperidin-1-ylsulfonylphenyl)cyclohexanecarboxamide
CID 1013273
N-(4-methoxyphenyl)-4-(4-methoxyphenyl)sulfonylpiperazine-1-carboxamide
CID 6470039
N-[4-[(4-acetyl-1,4-diazepan-1-yl)sulfonyl]phenyl]acetamide
CID 3573154
4-(azepan-1-ylsulfonyl)-N-[4-[4-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]phenyl]phenyl]benzamide
CID 3537523
N-[4-[4-(piperidine-1-carbonyl)piperidin-1-yl]sulfonylphenyl]acetamide
CID 26947333
4-[4-(azepan-1-ylsulfonyl)anilino]-4-oxobutanoate
CID 6968365

Frequently Asked Questions

What is the IUPAC name of N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide?
The IUPAC name of N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide (CID 6460433) is N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide?
The canonical SMILES for N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide is O=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCC1.
What is the InChIKey of N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide?
The InChIKey is LZCZWVKJHOOIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3S/c20-16(18-10-2-1-3-11-18)17-14-6-8-15(9-7-14)23(21,22)19-12-4-5-13-19/h6-9H,1-5,10-13H2,(H,17,20).
What are the key properties of N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide?
N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide has a molecular weight of 337.44 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 6460433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).