5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide

C13H12ClNO3 — CID 54903867

IUPAC5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide
SMILESO=C(NCCc1ccc(O)cc1)c1ccc(Cl)o1
InChIInChI=1S/C13H12ClNO3/c14-12-6-5-11(18-12)13(17)15-8-7-9-1-3-10(16)4-2-9/h1-6,16H,7-8H2,(H,15,17)
InChIKeyDYHGXQSLVUEPLM-UHFFFAOYSA-N
MW265.70 g/mol
LogP2.61
Rot. Bonds4

About 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide

5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide (PubChem CID 54903867) has the molecular formula C13H12ClNO3 and a molecular weight of 265.70 g/mol. Its IUPAC name is 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide
PubChem CID54903867
Molecular FormulaC13H12ClNO3
Molecular Weight265.70 g/mol
Exact Mass265.05
IUPAC Name5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide
SMILESO=C(NCCc1ccc(O)cc1)c1ccc(Cl)o1
InChIInChI=1S/C13H12ClNO3/c14-12-6-5-11(18-12)13(17)15-8-7-9-1-3-10(16)4-2-9/h1-6,16H,7-8H2,(H,15,17)
InChIKeyDYHGXQSLVUEPLM-UHFFFAOYSA-N
XLogP2.61
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-[2-(3,5-difluorophenyl)ethyl]furan-2-carboxamide
CID 113228849
N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide
CID 4108306
3-[2-[(5-chlorofuran-2-carbonyl)amino]ethyl]benzoic acid
CID 63795812
5-chloro-N-(5,5,5-trifluoropentyl)furan-2-carboxamide
CID 103839345
5-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]furan-2-carboxamide
CID 104693705
5-chloro-N-[2-(cyclohexen-1-yl)ethyl]furan-2-carboxamide
CID 29413921
5-chloro-N-[2-(ethylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119508521
5-chloro-N-[2-(propylamino)ethyl]furan-2-carboxamide
CID 62659012
2,6-dichloro-N-[2-(4-hydroxyphenyl)ethyl]pyridine-4-carboxamide
CID 61237115
2-[2-[(5-chlorofuran-2-carbonyl)amino]ethoxy]acetic acid
CID 79468837
5-chloro-N-(2-chloropropyl)furan-2-carboxamide
CID 106689974
5-chloro-N-[2-(4-hydroxyphenyl)ethyl]pyrazine-2-carboxamide
CID 107252358

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide?
The IUPAC name of 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide (CID 54903867) is 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide is O=C(NCCc1ccc(O)cc1)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide?
The InChIKey is DYHGXQSLVUEPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO3/c14-12-6-5-11(18-12)13(17)15-8-7-9-1-3-10(16)4-2-9/h1-6,16H,7-8H2,(H,15,17).
What are the key properties of 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide?
5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide has a molecular weight of 265.70 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(4-hydroxyphenyl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 54903867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).