N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide

C18H13NO3 — CID 86994462

IUPACN-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide
SMILESO=C(NCc1cc2ccccc2o1)c1cc2ccccc2o1
InChIInChI=1S/C18H13NO3/c20-18(17-10-13-6-2-4-8-16(13)22-17)19-11-14-9-12-5-1-3-7-15(12)21-14/h1-10H,11H2,(H,19,20)
InChIKeyIULCQPDXPFSQSF-UHFFFAOYSA-N
MW291.31 g/mol
LogP4.11
Rot. Bonds3

About N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide

N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide (PubChem CID 86994462) has the molecular formula C18H13NO3 and a molecular weight of 291.31 g/mol. Its IUPAC name is N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide
PubChem CID86994462
Molecular FormulaC18H13NO3
Molecular Weight291.31 g/mol
Exact Mass291.09
IUPAC NameN-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide
SMILESO=C(NCc1cc2ccccc2o1)c1cc2ccccc2o1
InChIInChI=1S/C18H13NO3/c20-18(17-10-13-6-2-4-8-16(13)22-17)19-11-14-9-12-5-1-3-7-15(12)21-14/h1-10H,11H2,(H,19,20)
InChIKeyIULCQPDXPFSQSF-UHFFFAOYSA-N
XLogP4.11
TPSA55.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-acetylphenyl)methyl]-1-benzofuran-2-carboxamide
CID 20677387
N-(2-aminopropyl)-1-benzofuran-2-carboxamide;hydrochloride
CID 69484360
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-benzofuran-2-carboxamide
CID 47344961
N-[(2-ethoxyphenyl)methyl]-1-benzofuran-2-carboxamide
CID 53285925
N-[[5-(furan-3-yl)furan-2-yl]methyl]-1-benzofuran-2-carboxamide
CID 122244115
N-prop-2-ynyl-1-benzofuran-2-carboxamide
CID 60646228
N-(1-benzofuran-2-ylmethyl)-3-methylquinoxaline-2-carboxamide
CID 140966924
N-(3-iodopropyl)-1-benzofuran-2-carboxamide
CID 114504013
N-(2-chloropropyl)-1-benzofuran-2-carboxamide
CID 114296217
N-[2-(1-benzofuran-2-ylmethylamino)-2-oxoethyl]benzamide
CID 87018603
N-[[3-(methoxymethyl)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 46487608
N-[(3-bromothiophen-2-yl)methyl]-1-benzofuran-2-carboxamide
CID 78985913

Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide (CID 86994462) is N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide is O=C(NCc1cc2ccccc2o1)c1cc2ccccc2o1.
What is the InChIKey of N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide?
The InChIKey is IULCQPDXPFSQSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO3/c20-18(17-10-13-6-2-4-8-16(13)22-17)19-11-14-9-12-5-1-3-7-15(12)21-14/h1-10H,11H2,(H,19,20).
What are the key properties of N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide?
N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide has a molecular weight of 291.31 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 86994462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).