N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide

C19H22N2O3 — CID 71977522

IUPACN-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide
SMILESO=C(NC1(C(=O)NCC2CC2)CCCC1)c1cc2ccccc2o1
InChIInChI=1S/C19H22N2O3/c22-17(16-11-14-5-1-2-6-15(14)24-16)21-19(9-3-4-10-19)18(23)20-12-13-7-8-13/h1-2,5-6,11,13H,3-4,7-10,12H2,(H,20,23)(H,21,22)
InChIKeyRJOLKZMRWRRYRF-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.00
Rot. Bonds5

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

N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide (PubChem CID 71977522) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide
PubChem CID71977522
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide
SMILESO=C(NC1(C(=O)NCC2CC2)CCCC1)c1cc2ccccc2o1
InChIInChI=1S/C19H22N2O3/c22-17(16-11-14-5-1-2-6-15(14)24-16)21-19(9-3-4-10-19)18(23)20-12-13-7-8-13/h1-2,5-6,11,13H,3-4,7-10,12H2,(H,20,23)(H,21,22)
InChIKeyRJOLKZMRWRRYRF-UHFFFAOYSA-N
XLogP3.00
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(chloromethyl)-4-methylcyclohexyl]-1-benzofuran-2-carboxamide
CID 114304186
N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1H-indole-5-carboxamide
CID 71862139
N-[4-(aminomethyl)oxan-4-yl]-1-benzofuran-2-carboxamide
CID 106297306
N-[2-(1-benzofuran-2-carbonylamino)cyclohexyl]-1-benzofuran-2-carboxamide
CID 171722189
N-[1-(4-fluorophenyl)cyclopentyl]-1-benzofuran-2-carboxamide
CID 51126172
N-[[1-(2-hydroxyethoxy)cyclopentyl]methyl]-1-benzofuran-2-carboxamide
CID 131702310
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-1-benzofuran-2-carboxamide
CID 114758782
5-chloro-N-[1-[[(2R)-1-[[1-(oxan-4-yl)piperidin-4-yl]methylamino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]cyclopentyl]-1-benzofuran-2-carboxamide
CID 90960247
N-[(2R)-2-cyclopropyl-2-hydroxypropyl]-1-benzofuran-2-carboxamide
CID 52907053
N-[[1-(2-bromoethyl)cyclopropyl]methyl]-1-benzofuran-2-carboxamide
CID 114758419
N-[1-[[1-[2-(3,3-dimethyl-2-oxoazetidin-1-yl)phenyl]-3-oxopiperidin-4-yl]carbamoyl]cyclohexyl]-1-benzofuran-2-carboxamide
CID 10437710
N-[1-[[1-(5-fluoro-2-pyrrol-1-ylphenyl)-3-oxopiperidin-4-yl]carbamoyl]cyclohexyl]-1-benzofuran-2-carboxamide
CID 69312939

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide (CID 71977522) is N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide is O=C(NC1(C(=O)NCC2CC2)CCCC1)c1cc2ccccc2o1.
What is the InChIKey of N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide?
The InChIKey is RJOLKZMRWRRYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c22-17(16-11-14-5-1-2-6-15(14)24-16)21-19(9-3-4-10-19)18(23)20-12-13-7-8-13/h1-2,5-6,11,13H,3-4,7-10,12H2,(H,20,23)(H,21,22).
What are the key properties of N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide?
N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopropylmethylcarbamoyl)cyclopentyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 71977522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).