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

C18H16N2O3S — CID 122132677

IUPACN-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide
SMILESCc1cc(NC(=O)c2sccc2C)ccc1NC(=O)c1ccco1
InChIInChI=1S/C18H16N2O3S/c1-11-7-9-24-16(11)18(22)19-13-5-6-14(12(2)10-13)20-17(21)15-4-3-8-23-15/h3-10H,1-2H3,(H,19,22)(H,20,21)
InChIKeyILSZXRNBFNWWFY-UHFFFAOYSA-N
MW340.40 g/mol
LogP4.46
Rot. Bonds4

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

N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide (PubChem CID 122132677) has the molecular formula C18H16N2O3S and a molecular weight of 340.40 g/mol. Its IUPAC name is N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide
PubChem CID122132677
Molecular FormulaC18H16N2O3S
Molecular Weight340.40 g/mol
Exact Mass340.09
IUPAC NameN-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide
SMILESCc1cc(NC(=O)c2sccc2C)ccc1NC(=O)c1ccco1
InChIInChI=1S/C18H16N2O3S/c1-11-7-9-24-16(11)18(22)19-13-5-6-14(12(2)10-13)20-17(21)15-4-3-8-23-15/h3-10H,1-2H3,(H,19,22)(H,20,21)
InChIKeyILSZXRNBFNWWFY-UHFFFAOYSA-N
XLogP4.46
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-methyl-4-(methylamino)phenyl]furan-2-carboxamide
CID 91677831
N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1141339
N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 689600
N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide
CID 131889577
5-(dimethylsulfamoyl)-N-[4-(furan-2-carbonylamino)-3-methylphenyl]furan-2-carboxamide
CID 154858775
N-[4-(3-chloropropanoylamino)-2-methylphenyl]furan-2-carboxamide
CID 4221258
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-(4-iodo-2-methylphenyl)furan-2-carboxamide
CID 723686
N-[2-methyl-4-[(4-propan-2-yloxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 1086037
N-[4-(3-aminobutanoylamino)-2-methylphenyl]furan-2-carboxamide
CID 119743182
5-(3,4-dimethylphenyl)-N-[4-(furan-2-carbonylamino)-3-methylphenyl]furan-2-carboxamide
CID 4287180

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide (CID 122132677) is N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide is Cc1cc(NC(=O)c2sccc2C)ccc1NC(=O)c1ccco1.
What is the InChIKey of N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide?
The InChIKey is ILSZXRNBFNWWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3S/c1-11-7-9-24-16(11)18(22)19-13-5-6-14(12(2)10-13)20-17(21)15-4-3-8-23-15/h3-10H,1-2H3,(H,19,22)(H,20,21).
What are the key properties of N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide?
N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide has a molecular weight of 340.40 g/mol, XLogP of 4.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 122132677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).