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

C20H18FNO2 — CID 51126172

IUPACN-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide
SMILESO=C(NC1(c2ccc(F)cc2)CCCC1)c1cc2ccccc2o1
InChIInChI=1S/C20H18FNO2/c21-16-9-7-15(8-10-16)20(11-3-4-12-20)22-19(23)18-13-14-5-1-2-6-17(14)24-18/h1-2,5-10,13H,3-4,11-12H2,(H,22,23)
InChIKeyPNMFELCNSTVABS-UHFFFAOYSA-N
MW323.37 g/mol
LogP4.77
Rot. Bonds3

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

N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide (PubChem CID 51126172) has the molecular formula C20H18FNO2 and a molecular weight of 323.37 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide
PubChem CID51126172
Molecular FormulaC20H18FNO2
Molecular Weight323.37 g/mol
Exact Mass323.13
IUPAC NameN-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide
SMILESO=C(NC1(c2ccc(F)cc2)CCCC1)c1cc2ccccc2o1
InChIInChI=1S/C20H18FNO2/c21-16-9-7-15(8-10-16)20(11-3-4-12-20)22-19(23)18-13-14-5-1-2-6-17(14)24-18/h1-2,5-10,13H,3-4,11-12H2,(H,22,23)
InChIKeyPNMFELCNSTVABS-UHFFFAOYSA-N
XLogP4.77
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.37
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-5-[[1-(4-fluorophenyl)cyclopentyl]carbamoyl]furan-3-carboxylic acid
CID 120821464
4-(aminomethyl)-N-[1-(4-fluorophenyl)cyclopentyl]benzamide;hydrochloride
CID 119305591
N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide
CID 71977522
N-[1-(4-fluorophenyl)cyclopentyl]acetamide
CID 71936960
N-[4-(aminomethyl)oxan-4-yl]-1-benzofuran-2-carboxamide
CID 106297306
2-amino-N-[1-(4-fluorophenyl)cyclopropyl]benzamide
CID 110465658
N-(2-amino-6-fluorophenyl)-1-benzofuran-2-carboxamide
CID 81315294
N-[2-(1-benzofuran-2-carbonylamino)cyclohexyl]-1-benzofuran-2-carboxamide
CID 171722189
3,4-dichloro-N-[1-(4-fluorophenyl)cyclobutyl]benzamide
CID 110444172
N-[(3-hydroxypyrrolidin-3-yl)methyl]-1-benzofuran-2-carboxamide
CID 114760777
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-1-benzofuran-2-carboxamide
CID 114758782
N-[1-(1-benzofuran-2-yl)ethylideneamino]-4-fluorobenzamide
CID 3509518

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide (CID 51126172) is N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide is O=C(NC1(c2ccc(F)cc2)CCCC1)c1cc2ccccc2o1.
What is the InChIKey of N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide?
The InChIKey is PNMFELCNSTVABS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FNO2/c21-16-9-7-15(8-10-16)20(11-3-4-12-20)22-19(23)18-13-14-5-1-2-6-17(14)24-18/h1-2,5-10,13H,3-4,11-12H2,(H,22,23).
What are the key properties of N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide?
N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide has a molecular weight of 323.37 g/mol, XLogP of 4.77, 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]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 51126172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).