3-methyl-N-(3-methylphenyl)furan-2-carboxamide

C13H13NO2 — CID 38770464

IUPAC3-methyl-N-(3-methylphenyl)furan-2-carboxamide
SMILESCc1cccc(NC(=O)c2occc2C)c1
InChIInChI=1S/C13H13NO2/c1-9-4-3-5-11(8-9)14-13(15)12-10(2)6-7-16-12/h3-8H,1-2H3,(H,14,15)
InChIKeyDHLAZXRTXXMRDM-UHFFFAOYSA-N
MW215.25 g/mol
LogP3.15
Rot. Bonds2

About 3-methyl-N-(3-methylphenyl)furan-2-carboxamide

3-methyl-N-(3-methylphenyl)furan-2-carboxamide (PubChem CID 38770464) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 3-methyl-N-(3-methylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(3-methylphenyl)furan-2-carboxamide
PubChem CID38770464
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name3-methyl-N-(3-methylphenyl)furan-2-carboxamide
SMILESCc1cccc(NC(=O)c2occc2C)c1
InChIInChI=1S/C13H13NO2/c1-9-4-3-5-11(8-9)14-13(15)12-10(2)6-7-16-12/h3-8H,1-2H3,(H,14,15)
InChIKeyDHLAZXRTXXMRDM-UHFFFAOYSA-N
XLogP3.15
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-iodophenyl)-3-methylfuran-2-carboxamide
CID 27445102
3-methyl-N-[3-(sulfamoylamino)phenyl]furan-2-carboxamide
CID 60728536
N-(4-bromo-3,5-dimethylphenyl)-3-methylfuran-2-carboxamide
CID 103581989
3-[3-[(3-methylfuran-2-carbonyl)amino]phenyl]propanoic acid
CID 115339330
2-bromo-N-(3-methylphenyl)furan-3-carboxamide
CID 106852319
N-(4-aminophenyl)-3-methylfuran-2-carboxamide
CID 16772874
3-[2-methyl-5-[(3-methylfuran-2-carbonyl)amino]phenyl]prop-2-enoic acid
CID 77011731
N-(9H-fluoren-2-yl)-3-methylfuran-2-carboxamide
CID 38708919
2,5-dimethyl-N-(3-methylphenyl)benzamide
CID 925357
N-(3-methylphenyl)furan-3-carboxamide
CID 27007768
N-(4-ethylphenyl)-3-methylfuran-2-carboxamide
CID 18106134
N-(3-methylphenyl)acetamide
CID 10843

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-methylphenyl)furan-2-carboxamide?
The IUPAC name of 3-methyl-N-(3-methylphenyl)furan-2-carboxamide (CID 38770464) is 3-methyl-N-(3-methylphenyl)furan-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(3-methylphenyl)furan-2-carboxamide?
The canonical SMILES for 3-methyl-N-(3-methylphenyl)furan-2-carboxamide is Cc1cccc(NC(=O)c2occc2C)c1.
What is the InChIKey of 3-methyl-N-(3-methylphenyl)furan-2-carboxamide?
The InChIKey is DHLAZXRTXXMRDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-9-4-3-5-11(8-9)14-13(15)12-10(2)6-7-16-12/h3-8H,1-2H3,(H,14,15).
What are the key properties of 3-methyl-N-(3-methylphenyl)furan-2-carboxamide?
3-methyl-N-(3-methylphenyl)furan-2-carboxamide has a molecular weight of 215.25 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-methylphenyl)furan-2-carboxamide is sourced from PubChem (CID 38770464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).