N-(3,4-dimethylphenyl)furan-2-carboxamide

C13H13NO2 — CID 689600

IUPACN-(3,4-dimethylphenyl)furan-2-carboxamide
SMILESCC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)C
InChIInChI=1S/C13H13NO2/c1-9-5-6-11(8-10(9)2)14-13(15)12-4-3-7-16-12/h3-8H,1-2H3,(H,14,15)
InChIKeyVEGUVCOEABXDND-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.90
Rot. Bonds2

About N-(3,4-dimethylphenyl)furan-2-carboxamide

N-(3,4-dimethylphenyl)furan-2-carboxamide (PubChem CID 689600) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)furan-2-carboxamide
PubChem CID689600
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC NameN-(3,4-dimethylphenyl)furan-2-carboxamide
SMILESCC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)C
InChIInChI=1S/C13H13NO2/c1-9-5-6-11(8-10(9)2)14-13(15)12-4-3-7-16-12/h3-8H,1-2H3,(H,14,15)
InChIKeyVEGUVCOEABXDND-UHFFFAOYSA-N
XLogP2.90
TPSA42.20 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity254

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylphenyl)furan-2-carboxamide
CID 785196
4'-Methyl-2'-nitro-2-furanilide
CID 2837048
N-Phenyl-2-furancarboxamide
CID 220406
Mls003171585
CID 347463
N-(3-fluorophenyl)furan-2-carboxamide
CID 306831
(E)-N-(2-methyl-4-(o-tolyldiazenyl)phenyl)furan-2-carboxamide
CID 2827423
4'-Methoxy-2-furanilide
CID 303388
N-(4-Fluorophenyl)-2-furamide
CID 531893
N-[3-acetamido-5-[(5-acetyl-2-ethoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 132275014
N-[3-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]phenyl]furan-2-carboxamide
CID 152426927
3-Methyl-furan-2-carboxylic acid naphthalen-2-ylamide
CID 573329
3-Methyl-furan-2-carboxylic acid naphthalen-1-ylamide
CID 573330

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)furan-2-carboxamide?
The IUPAC name of N-(3,4-dimethylphenyl)furan-2-carboxamide (CID 689600) is N-(3,4-dimethylphenyl)furan-2-carboxamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)furan-2-carboxamide?
The canonical SMILES for N-(3,4-dimethylphenyl)furan-2-carboxamide is CC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)C.
What is the InChIKey of N-(3,4-dimethylphenyl)furan-2-carboxamide?
The InChIKey is VEGUVCOEABXDND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-9-5-6-11(8-10(9)2)14-13(15)12-4-3-7-16-12/h3-8H,1-2H3,(H,14,15).
What are the key properties of N-(3,4-dimethylphenyl)furan-2-carboxamide?
N-(3,4-dimethylphenyl)furan-2-carboxamide has a molecular weight of 215.25 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)furan-2-carboxamide is sourced from PubChem (CID 689600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).