1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide

C17H23FN2O3S — CID 75479820

IUPAC1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide
SMILESO=C(NS(=O)(=O)N1CCCCC1)C1(c2ccc(F)cc2)CCCC1
InChIInChI=1S/C17H23FN2O3S/c18-15-8-6-14(7-9-15)17(10-2-3-11-17)16(21)19-24(22,23)20-12-4-1-5-13-20/h6-9H,1-5,10-13H2,(H,19,21)
InChIKeySZTHTVVRZQIHDY-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.48
Rot. Bonds4

About 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide

1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide (PubChem CID 75479820) has the molecular formula C17H23FN2O3S and a molecular weight of 354.45 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide
PubChem CID75479820
Molecular FormulaC17H23FN2O3S
Molecular Weight354.45 g/mol
Exact Mass354.14
IUPAC Name1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide
SMILESO=C(NS(=O)(=O)N1CCCCC1)C1(c2ccc(F)cc2)CCCC1
InChIInChI=1S/C17H23FN2O3S/c18-15-8-6-14(7-9-15)17(10-2-3-11-17)16(21)19-24(22,23)20-12-4-1-5-13-20/h6-9H,1-5,10-13H2,(H,19,21)
InChIKeySZTHTVVRZQIHDY-UHFFFAOYSA-N
XLogP2.48
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[1-(4-fluorophenyl)cyclopentanecarbonyl]piperazine-1-sulfonamide
CID 51133844
1-(4-fluorophenyl)-N-pyrazin-2-ylsulfonylcyclobutane-1-carboxamide
CID 99696724
1-(4-fluorophenyl)cyclopentane-1-carboxylate
CID 6931371
2-[[1-(4-fluorophenyl)cyclopentanecarbonyl]amino]-3-hydroxypropanoic acid
CID 138031119
N-(2-aminoethyl)-1-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119384814
N-cyclopropyl-1-[1-(4-fluorophenyl)cyclopentanecarbonyl]piperidine-3-carboxamide
CID 49352658
[4-(benzenesulfonyl)piperazin-1-yl]-[1-(4-fluorophenyl)cyclobutyl]methanone
CID 46561290
N-[(1R)-1-(4-fluorophenyl)ethyl]-1-[4-(methanesulfonamido)phenyl]cyclohexane-1-carboxamide
CID 95086523
1-[1-(4-fluorophenyl)cyclohexanecarbonyl]-1,4-diazepan-5-one
CID 56821181
(4-cyclohexyloxypiperidin-1-yl)-[1-(4-fluorophenyl)cyclopentyl]methanone
CID 86873749
1-(4-fluorophenyl)-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 112537817
N-(2-amino-2-oxoethyl)-1-(4-fluorophenyl)cyclobutane-1-carboxamide
CID 110473843

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide (CID 75479820) is 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide is O=C(NS(=O)(=O)N1CCCCC1)C1(c2ccc(F)cc2)CCCC1.
What is the InChIKey of 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide?
The InChIKey is SZTHTVVRZQIHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O3S/c18-15-8-6-14(7-9-15)17(10-2-3-11-17)16(21)19-24(22,23)20-12-4-1-5-13-20/h6-9H,1-5,10-13H2,(H,19,21).
What are the key properties of 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide?
1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide has a molecular weight of 354.45 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-piperidin-1-ylsulfonylcyclopentane-1-carboxamide is sourced from PubChem (CID 75479820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).