N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide

C16H14N2O2 — CID 4825824

IUPACN-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide
SMILESO=C(NCCc1ccccn1)c1cc2ccccc2o1
InChIInChI=1S/C16H14N2O2/c19-16(18-10-8-13-6-3-4-9-17-13)15-11-12-5-1-2-7-14(12)20-15/h1-7,9,11H,8,10H2,(H,18,19)
InChIKeyZTUDFNFNBFDPAS-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.80
Rot. Bonds4

About N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide

N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide (PubChem CID 4825824) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide
PubChem CID4825824
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC NameN-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide
SMILESO=C(NCCc1ccccn1)c1cc2ccccc2o1
InChIInChI=1S/C16H14N2O2/c19-16(18-10-8-13-6-3-4-9-17-13)15-11-12-5-1-2-7-14(12)20-15/h1-7,9,11H,8,10H2,(H,18,19)
InChIKeyZTUDFNFNBFDPAS-UHFFFAOYSA-N
XLogP2.80
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Relacatib
CID 6918602
Bradanicline
CID 25147644
N-[(2S)-4-Methyl-1-oxo-1-{[(4S)-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino}-2-pentanyl]-1-benzofuran-2-carboxamide
CID 5287468
5-(2-Morpholin-4-ylethoxy)benzofuran-2-carboxylic acid ((S)-3-methyl-1-{(S)-3-oxo-1-[2-(3-pyridin-2-ylphenyl)acetyl]azepan-4-ylcarbamoyl}butyl)amide
CID 5287549
(2S)-2-(1-benzofuran-2-ylformamido)-4-methyl-N-[(4S,5S)-5-methyl-3-oxo-1-(pyridine-2-sulfonyl)azepan-4-yl]pentanamide
CID 10165785
(2S)-2-(1-benzofuran-2-ylformamido)-4-methyl-N-[(4S,6S)-6-methyl-3-oxo-1-(pyridine-2-sulfonyl)azepan-4-yl]pentanamide
CID 11692372
N-[(3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]-1-benzofuran-2-carboxamide
CID 71463351
N-(3-chloropyridin-2-yl)-1-benzofuran-2-carboxamide
CID 949440
N-[(2S)-4-Methyl-1-[[(4R,7S)-7-methyl-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]-1-oxopentan-2-yl]-1-benzofuran-2-carboxamide
CID 10143615
(2S)-2-(1-benzofuran-2-ylformamido)-4-methyl-N-[(4R,5S)-5-methyl-3-oxo-1-(pyridine-2-sulfonyl)azepan-4-yl]pentanamide
CID 10165786
(2S)-2-(1-benzofuran-2-ylformamido)-4-methyl-N-[(4S,5R)-5-methyl-3-oxo-1-(pyridine-2-sulfonyl)azepan-4-yl]pentanamide
CID 10187189
(2S)-2-(1-benzofuran-2-ylformamido)-4-methyl-N-[(4R,5R)-5-methyl-3-oxo-1-(pyridine-2-sulfonyl)azepan-4-yl]pentanamide
CID 10187190

Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide (CID 4825824) is N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide is O=C(NCCc1ccccn1)c1cc2ccccc2o1.
What is the InChIKey of N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide?
The InChIKey is ZTUDFNFNBFDPAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c19-16(18-10-8-13-6-3-4-9-17-13)15-11-12-5-1-2-7-14(12)20-15/h1-7,9,11H,8,10H2,(H,18,19).
What are the key properties of N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide?
N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 4825824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).