5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide

C15H15ClN2O4S — CID 17431155

IUPAC5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(Cl)o1
InChIInChI=1S/C15H15ClN2O4S/c16-14-8-7-13(22-14)15(19)17-11-3-5-12(6-4-11)23(20,21)18-9-1-2-10-18/h3-8H,1-2,9-10H2,(H,17,19)
InChIKeyNARYQZHXCJMCQR-UHFFFAOYSA-N
MW354.82 g/mol
LogP2.97
Rot. Bonds4

About 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide

5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide (PubChem CID 17431155) has the molecular formula C15H15ClN2O4S and a molecular weight of 354.82 g/mol. Its IUPAC name is 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide
PubChem CID17431155
Molecular FormulaC15H15ClN2O4S
Molecular Weight354.82 g/mol
Exact Mass354.04
IUPAC Name5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(Cl)o1
InChIInChI=1S/C15H15ClN2O4S/c16-14-8-7-13(22-14)15(19)17-11-3-5-12(6-4-11)23(20,21)18-9-1-2-10-18/h3-8H,1-2,9-10H2,(H,17,19)
InChIKeyNARYQZHXCJMCQR-UHFFFAOYSA-N
XLogP2.97
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.82
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylsulfonylphenyl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55630451
4-pyrrolidin-1-ylsulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 26252425
5-(4-acetylphenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide
CID 2557228
1-N,4-N-bis[4-(azepan-1-ylsulfonyl)phenyl]benzene-1,4-dicarboxamide
CID 5167539
2,5-dichloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 3387472
N-(4-piperidin-1-ylsulfonylphenyl)-1-benzofuran-2-carboxamide
CID 6459741
N-[4-(azepan-1-ylsulfonyl)phenyl]-1-benzofuran-2-carboxamide
CID 9362905
N-(4-bromophenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 46385831
1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-chlorophenyl)urea
CID 1011433
2-bromo-N-(4-chlorophenyl)-5-pyrrolidin-1-ylsulfonylbenzamide
CID 26087511
methyl 4-[(5-pyrrolidin-1-ylsulfonylfuran-2-carbonyl)amino]benzoate
CID 46547480
N-(4-ethylphenyl)-4-piperidin-1-ylsulfonylbenzamide
CID 26697285

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide?
The IUPAC name of 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide (CID 17431155) is 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide is O=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide?
The InChIKey is NARYQZHXCJMCQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O4S/c16-14-8-7-13(22-14)15(19)17-11-3-5-12(6-4-11)23(20,21)18-9-1-2-10-18/h3-8H,1-2,9-10H2,(H,17,19).
What are the key properties of 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide?
5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide has a molecular weight of 354.82 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide is sourced from PubChem (CID 17431155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).