N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide

C14H15NO4 — CID 79673533

IUPACN-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC(C)c2ccco2)cc1O
InChIInChI=1S/C14H15NO4/c1-9(12-4-3-7-19-12)15-14(17)10-5-6-13(18-2)11(16)8-10/h3-9,16H,1-2H3,(H,15,17)
InChIKeyVFDJSPXFSZXNQG-UHFFFAOYSA-N
MW261.28 g/mol
LogP2.48
Rot. Bonds4

About N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide

N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide (PubChem CID 79673533) has the molecular formula C14H15NO4 and a molecular weight of 261.28 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide
PubChem CID79673533
Molecular FormulaC14H15NO4
Molecular Weight261.28 g/mol
Exact Mass261.10
IUPAC NameN-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC(C)c2ccco2)cc1O
InChIInChI=1S/C14H15NO4/c1-9(12-4-3-7-19-12)15-14(17)10-5-6-13(18-2)11(16)8-10/h3-9,16H,1-2H3,(H,15,17)
InChIKeyVFDJSPXFSZXNQG-UHFFFAOYSA-N
XLogP2.48
TPSA71.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-4-methoxybenzamide
CID 9482281
N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methylbenzamide
CID 43402437
4-bromo-N-[1-(furan-2-yl)ethyl]-3-hydroxybenzamide
CID 103871268
N-[(1R)-1-(furan-2-yl)ethyl]-3-methoxy-4-phenylmethoxybenzamide
CID 9481817
N-[4-(furan-2-yl)butan-2-yl]-3-hydroxy-4-methoxybenzamide
CID 79671902
3-(cyclopropylsulfamoyl)-N-[(1R)-1-(furan-2-yl)ethyl]-4-methoxybenzamide
CID 9453559
3,4-dichloro-N-[(1S)-1-(furan-2-yl)ethyl]benzamide
CID 7995956
N-[1-(furan-2-yl)ethyl]-3-methoxynaphthalene-2-carboxamide
CID 18116872
3-[[(1R)-1-(furan-2-yl)ethyl]carbamoyl]benzoic acid
CID 51704043
3-hydroxy-N-(1-hydroxypropan-2-yl)-4-methoxybenzamide
CID 79732831
N-[1-(tert-butylamino)-1-oxopropan-2-yl]-3-hydroxy-4-methoxybenzamide
CID 115674461
4-bromo-3-chloro-N-[1-(furan-2-yl)ethyl]benzamide
CID 80965940

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide (CID 79673533) is N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)NC(C)c2ccco2)cc1O.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide?
The InChIKey is VFDJSPXFSZXNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO4/c1-9(12-4-3-7-19-12)15-14(17)10-5-6-13(18-2)11(16)8-10/h3-9,16H,1-2H3,(H,15,17).
What are the key properties of N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide?
N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide has a molecular weight of 261.28 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-3-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 79673533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).