N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide

C13H13NO3 — CID 652108

IUPACN-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(O)c2)c(C)o1
InChIInChI=1S/C13H13NO3/c1-8-6-12(9(2)17-8)13(16)14-10-4-3-5-11(15)7-10/h3-7,15H,1-2H3,(H,14,16)
InChIKeyGWGHIELBFHACFO-UHFFFAOYSA-N
MW231.25 g/mol
LogP2.85
Rot. Bonds2

About N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide

N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide (PubChem CID 652108) has the molecular formula C13H13NO3 and a molecular weight of 231.25 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide
PubChem CID652108
Molecular FormulaC13H13NO3
Molecular Weight231.25 g/mol
Exact Mass231.09
IUPAC NameN-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(O)c2)c(C)o1
InChIInChI=1S/C13H13NO3/c1-8-6-12(9(2)17-8)13(16)14-10-4-3-5-11(15)7-10/h3-7,15H,1-2H3,(H,14,16)
InChIKeyGWGHIELBFHACFO-UHFFFAOYSA-N
XLogP2.85
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Methfuroxam
CID 34313
Fenfuram
CID 90590
2,5-Dimethyl-3-furancarboxanilide
CID 34281
2-methyl-N-(4-phenylmethoxyphenyl)furan-3-carboxamide
CID 800833
5-Methyl-furan-3-carboxylic acid (4-methoxy-phenyl)-amide
CID 1075689
N-[4-(benzyloxy)phenyl]-2,5-dimethyl-3-furamide
CID 1247120
2-(3-(5-Methylfuran-2-yl)propanamido)benzoic acid
CID 4739233
(2,5-Dimethylfuran-3-yl)-[4-(3-methoxyphenyl)piperazin-1-yl]methanone
CID 7676900
4-[(5-Methyl-2-phenyl-furan-3-carbonyl)-amino]-benzoic acid
CID 603778
3-(Acetylamino)phenyl 2-methyl-3-furoate
CID 671246
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-3-furamide
CID 701527
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methylfuran-3-carboxamide
CID 726075

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide (CID 652108) is N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide is Cc1cc(C(=O)Nc2cccc(O)c2)c(C)o1.
What is the InChIKey of N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide?
The InChIKey is GWGHIELBFHACFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO3/c1-8-6-12(9(2)17-8)13(16)14-10-4-3-5-11(15)7-10/h3-7,15H,1-2H3,(H,14,16).
What are the key properties of N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide?
N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide has a molecular weight of 231.25 g/mol, XLogP of 2.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 652108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).