N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide

C16H16FNOS — CID 47424148

IUPACN-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide
SMILESO=C(NC1(c2ccc(F)cc2)CCCC1)c1cccs1
InChIInChI=1S/C16H16FNOS/c17-13-7-5-12(6-8-13)16(9-1-2-10-16)18-15(19)14-4-3-11-20-14/h3-8,11H,1-2,9-10H2,(H,18,19)
InChIKeyJNAAZAWVBGGKOG-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.09
Rot. Bonds3

About N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide

N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide (PubChem CID 47424148) has the molecular formula C16H16FNOS and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide
PubChem CID47424148
Molecular FormulaC16H16FNOS
Molecular Weight289.38 g/mol
Exact Mass289.09
IUPAC NameN-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide
SMILESO=C(NC1(c2ccc(F)cc2)CCCC1)c1cccs1
InChIInChI=1S/C16H16FNOS/c17-13-7-5-12(6-8-13)16(9-1-2-10-16)18-15(19)14-4-3-11-20-14/h3-8,11H,1-2,9-10H2,(H,18,19)
InChIKeyJNAAZAWVBGGKOG-UHFFFAOYSA-N
XLogP4.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide (CID 47424148) is N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide is O=C(NC1(c2ccc(F)cc2)CCCC1)c1cccs1.
What is the InChIKey of N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide?
The InChIKey is JNAAZAWVBGGKOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNOS/c17-13-7-5-12(6-8-13)16(9-1-2-10-16)18-15(19)14-4-3-11-20-14/h3-8,11H,1-2,9-10H2,(H,18,19).
What are the key properties of N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide?
N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)cyclopentyl]thiophene-2-carboxamide is sourced from PubChem (CID 47424148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).