2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide

C14H14ClNO3 — CID 106685543

IUPAC2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccoc2Cl)c(C)c1
InChIInChI=1S/C14H14ClNO3/c1-3-18-10-4-5-12(9(2)8-10)16-14(17)11-6-7-19-13(11)15/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyOHNMAJGJXVWQAJ-UHFFFAOYSA-N
MW279.72 g/mol
LogP3.89
Rot. Bonds4

About 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide

2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide (PubChem CID 106685543) has the molecular formula C14H14ClNO3 and a molecular weight of 279.72 g/mol. Its IUPAC name is 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide
PubChem CID106685543
Molecular FormulaC14H14ClNO3
Molecular Weight279.72 g/mol
Exact Mass279.07
IUPAC Name2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccoc2Cl)c(C)c1
InChIInChI=1S/C14H14ClNO3/c1-3-18-10-4-5-12(9(2)8-10)16-14(17)11-6-7-19-13(11)15/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyOHNMAJGJXVWQAJ-UHFFFAOYSA-N
XLogP3.89
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.72
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(4-ethoxy-2-methylphenyl)pyridine-4-carboxamide
CID 66465000
6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide
CID 61041819
2-chloro-N-(4-methyl-2-propoxyphenyl)furan-3-carboxamide
CID 106685527
2-chloro-N-(2-methyl-4-pyrrolidin-1-ylphenyl)furan-3-carboxamide
CID 106685905
3-amino-4-chloro-N-(4-ethoxy-2-methylphenyl)benzamide
CID 60928289
4-bromo-N-(4-ethoxy-2-methylphenyl)benzamide
CID 47267913
3-chloro-N-(4-ethoxy-2-methylphenyl)propanamide
CID 60933888
2-chloro-N-(4-ethoxy-2-methylphenyl)propanamide
CID 60933889
methyl 2-[(2-chlorofuran-3-carbonyl)amino]-5-methylbenzoate
CID 106685894
5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide
CID 47312097
2-chloro-N-(2,5-difluoro-4-methylphenyl)furan-3-carboxamide
CID 106687388
4-amino-N-(4-ethoxy-2-methylphenyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 62083175

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide (CID 106685543) is 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide is CCOc1ccc(NC(=O)c2ccoc2Cl)c(C)c1.
What is the InChIKey of 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide?
The InChIKey is OHNMAJGJXVWQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO3/c1-3-18-10-4-5-12(9(2)8-10)16-14(17)11-6-7-19-13(11)15/h4-8H,3H2,1-2H3,(H,16,17).
What are the key properties of 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide?
2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide has a molecular weight of 279.72 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide is sourced from PubChem (CID 106685543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).