N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide

C20H19NO2 — CID 40789963

IUPACN-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide
SMILESO=C(N[C@H](c1ccccc1)c1cc2ccccc2o1)C1CCC1
InChIInChI=1S/C20H19NO2/c22-20(15-10-6-11-15)21-19(14-7-2-1-3-8-14)18-13-16-9-4-5-12-17(16)23-18/h1-5,7-9,12-13,15,19H,6,10-11H2,(H,21,22)/t19-/m1/s1
InChIKeyWPGUSMRSNLPXIB-LJQANCHMSA-N
MW305.38 g/mol
LogP4.44
Rot. Bonds4

About N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide

N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide (PubChem CID 40789963) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide
PubChem CID40789963
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC NameN-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide
SMILESO=C(N[C@H](c1ccccc1)c1cc2ccccc2o1)C1CCC1
InChIInChI=1S/C20H19NO2/c22-20(15-10-6-11-15)21-19(14-7-2-1-3-8-14)18-13-16-9-4-5-12-17(16)23-18/h1-5,7-9,12-13,15,19H,6,10-11H2,(H,21,22)/t19-/m1/s1
InChIKeyWPGUSMRSNLPXIB-LJQANCHMSA-N
XLogP4.44
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-benzofuran-2-yl(phenyl)methyl]piperidine-3-carboxamide;hydrochloride
CID 119275756
3-amino-N-[1-benzofuran-2-yl(phenyl)methyl]cyclopentane-1-carboxamide
CID 119697972
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]cyclobutanecarboxamide
CID 9366149
(2S)-N-[(R)-1-benzofuran-2-yl(phenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 95905263
(3S)-N-[(R)-1-benzofuran-2-yl(phenyl)methyl]-3-methylpiperidine-1-carboxamide
CID 97023553
N-[1-benzofuran-2-yl(phenyl)methyl]morpholine-2-carboxamide
CID 119697982
N-[1-benzofuran-2-yl(phenyl)methyl]pyridine-4-carboxamide
CID 42925184
N-benzhydrylpiperidine-4-carboxamide
CID 119263888
4-amino-N-[1-benzofuran-2-yl(phenyl)methyl]pentanamide
CID 120559534
N-[(R)-1-benzofuran-2-yl(phenyl)methyl]-2-(2-fluorophenyl)acetamide
CID 51727752
N-[(S)-(4-methylphenyl)-phenylmethyl]cyclopentanecarboxamide
CID 8798133
1-(benzenesulfonyl)-N-[1-(1-benzofuran-2-yl)ethyl]piperidine-4-carboxamide
CID 55389739

Frequently Asked Questions

What is the IUPAC name of N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide?
The IUPAC name of N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide (CID 40789963) is N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide?
The canonical SMILES for N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide is O=C(N[C@H](c1ccccc1)c1cc2ccccc2o1)C1CCC1.
What is the InChIKey of N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide?
The InChIKey is WPGUSMRSNLPXIB-LJQANCHMSA-N. The full InChI is InChI=1S/C20H19NO2/c22-20(15-10-6-11-15)21-19(14-7-2-1-3-8-14)18-13-16-9-4-5-12-17(16)23-18/h1-5,7-9,12-13,15,19H,6,10-11H2,(H,21,22)/t19-/m1/s1.
What are the key properties of N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide?
N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide has a molecular weight of 305.38 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-1-benzofuran-2-yl(phenyl)methyl]cyclobutanecarboxamide is sourced from PubChem (CID 40789963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).