N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide

C20H18N2O3 — CID 1141339

IUPACN-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)c1
InChIInChI=1S/C20H18N2O3/c1-13-5-3-6-15(11-13)19(23)21-16-8-9-17(14(2)12-16)22-20(24)18-7-4-10-25-18/h3-12H,1-2H3,(H,21,23)(H,22,24)
InChIKeyZUEKSVBYYKJPJU-UHFFFAOYSA-N
MW334.38 g/mol
LogP4.40
Rot. Bonds4

About N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide

N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide (PubChem CID 1141339) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide
PubChem CID1141339
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC NameN-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)c1
InChIInChI=1S/C20H18N2O3/c1-13-5-3-6-15(11-13)19(23)21-16-8-9-17(14(2)12-16)22-20(24)18-7-4-10-25-18/h3-12H,1-2H3,(H,21,23)(H,22,24)
InChIKeyZUEKSVBYYKJPJU-UHFFFAOYSA-N
XLogP4.40
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide
CID 650804
N-[4-(furan-2-carbonylamino)-3-methylphenyl]-2,1,3-benzothiadiazole-5-carboxamide
CID 17274588
N-[2-methyl-4-(methylamino)phenyl]furan-2-carboxamide
CID 91677831
N-[4-[(furan-2-carbonylamino)carbamoyl]phenyl]-3-methylbenzamide
CID 3347367
N-[2-methyl-4-[(4-propan-2-yloxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 1086037
N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide
CID 131889577
N-[4-[(4-fluoro-2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 9426257
N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 689600
N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide
CID 122132677
N-[3-[(4-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 51179863
N-[5-[(3-carbamoylphenyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 78779252
N-[2-chloro-4-[(3,4-dimethylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1365415

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide (CID 1141339) is N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide is Cc1cccc(C(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)c1.
What is the InChIKey of N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide?
The InChIKey is ZUEKSVBYYKJPJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-13-5-3-6-15(11-13)19(23)21-16-8-9-17(14(2)12-16)22-20(24)18-7-4-10-25-18/h3-12H,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide?
N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 4.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 1141339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).