5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide

C14H14ClNO3 — CID 19240931

IUPAC5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide
SMILESO=C(NCC1CCCO1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C14H14ClNO3/c15-10-3-4-12-9(6-10)7-13(19-12)14(17)16-8-11-2-1-5-18-11/h3-4,6-7,11H,1-2,5,8H2,(H,16,17)
InChIKeyRDRWZNRTHVEGFQ-UHFFFAOYSA-N
MW279.72 g/mol
LogP2.99
Rot. Bonds3

About 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide

5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide (PubChem CID 19240931) has the molecular formula C14H14ClNO3 and a molecular weight of 279.72 g/mol. Its IUPAC name is 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide
PubChem CID19240931
Molecular FormulaC14H14ClNO3
Molecular Weight279.72 g/mol
Exact Mass279.07
IUPAC Name5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide
SMILESO=C(NCC1CCCO1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C14H14ClNO3/c15-10-3-4-12-9(6-10)7-13(19-12)14(17)16-8-11-2-1-5-18-11/h3-4,6-7,11H,1-2,5,8H2,(H,16,17)
InChIKeyRDRWZNRTHVEGFQ-UHFFFAOYSA-N
XLogP2.99
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.72
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-chloro-N-(oxolan-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

6-chloro-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]chromene-3-carboxamide
CID 862279
6-chloro-2-(5-chloro-2-fluorophenyl)imino-N-[[(2S)-oxolan-2-yl]methyl]chromene-3-carboxamide
CID 95184990
5-chloro-N-[(2-hydroxycyclopentyl)methyl]-1-benzofuran-2-carboxamide
CID 111464277
6-chloro-2-(4-chloro-2-fluorophenyl)imino-N-[[(2S)-oxolan-2-yl]methyl]chromene-3-carboxamide
CID 95184948
6-chloro-2-(4-chloro-2-methylphenyl)imino-N-[[(2S)-oxolan-2-yl]methyl]chromene-3-carboxamide
CID 95184968
2-amino-4-chloro-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 28690163
5-amino-N-[2-(oxolan-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 61127124
6-chloro-2-(3,4-dimethylphenyl)imino-N-(oxolan-2-ylmethyl)chromene-3-carboxamide
CID 51366998
6-chloro-2-(4-methoxyphenyl)imino-N-[[(2S)-oxolan-2-yl]methyl]chromene-3-carboxamide
CID 95184892
6-chloro-2-(2,5-dimethylphenyl)imino-N-[[(2S)-oxolan-2-yl]methyl]chromene-3-carboxamide
CID 95184890
6-chloro-2-(4-fluoro-3-methylphenyl)imino-N-[[(2S)-oxolan-2-yl]methyl]chromene-3-carboxamide
CID 95184972
6-chloro-N-[[(2R)-oxolan-2-yl]methyl]-2-(4-propan-2-ylphenyl)iminochromene-3-carboxamide
CID 95184885

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide?
The IUPAC name of 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide (CID 19240931) is 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide is O=C(NCC1CCCO1)c1cc2cc(Cl)ccc2o1.
What is the InChIKey of 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide?
The InChIKey is RDRWZNRTHVEGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO3/c15-10-3-4-12-9(6-10)7-13(19-12)14(17)16-8-11-2-1-5-18-11/h3-4,6-7,11H,1-2,5,8H2,(H,16,17).
What are the key properties of 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide?
5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide has a molecular weight of 279.72 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(oxolan-2-ylmethyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 19240931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).