N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide

C19H24N2O4 — CID 131890754

IUPACN-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide
SMILESCOc1cc(NC(=O)c2cc(C)oc2C)ccc1NC(=O)CC(C)C
InChIInChI=1S/C19H24N2O4/c1-11(2)8-18(22)21-16-7-6-14(10-17(16)24-5)20-19(23)15-9-12(3)25-13(15)4/h6-7,9-11H,8H2,1-5H3,(H,20,23)(H,21,22)
InChIKeyYBCSCRPPUKQSJW-UHFFFAOYSA-N
MW344.41 g/mol
LogP4.14
Rot. Bonds6

About N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide

N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide (PubChem CID 131890754) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide
PubChem CID131890754
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC NameN-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide
SMILESCOc1cc(NC(=O)c2cc(C)oc2C)ccc1NC(=O)CC(C)C
InChIInChI=1S/C19H24N2O4/c1-11(2)8-18(22)21-16-7-6-14(10-17(16)24-5)20-19(23)15-9-12(3)25-13(15)4/h6-7,9-11H,8H2,1-5H3,(H,20,23)(H,21,22)
InChIKeyYBCSCRPPUKQSJW-UHFFFAOYSA-N
XLogP4.14
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-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-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,4-dimethylbenzamide
CID 131938422
3-fluoro-N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]pyridine-4-carboxamide
CID 131905829
N-(4-amino-2-methoxyphenyl)-2,5-dimethylfuran-3-carboxamide
CID 16790725
2,5-dimethyl-N-(2-propan-2-yloxyphenyl)furan-3-carboxamide
CID 39000210
N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 131900789
N-(5-chloro-2,4-dimethoxyphenyl)-2,5-dimethylfuran-3-carboxamide
CID 17172995
5-fluoro-2-methoxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide
CID 33037269
N-[4-[[2-(1,2-benzoxazol-3-yl)acetyl]amino]-2-methoxyphenyl]-3-methylbutanamide
CID 50958245
N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-2-methylbenzamide
CID 953068
N-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-3-methylbutanamide
CID 112999279
N-[2-(4-methoxyanilino)sulfanyl-4-methylphenyl]-2,5-dimethylfuran-3-carboxamide
CID 170977107
3,4,5-trimethoxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide
CID 17193980

Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide (CID 131890754) is N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide is COc1cc(NC(=O)c2cc(C)oc2C)ccc1NC(=O)CC(C)C.
What is the InChIKey of N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide?
The InChIKey is YBCSCRPPUKQSJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-11(2)8-18(22)21-16-7-6-14(10-17(16)24-5)20-19(23)15-9-12(3)25-13(15)4/h6-7,9-11H,8H2,1-5H3,(H,20,23)(H,21,22).
What are the key properties of N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide?
N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 4.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-4-(3-methylbutanoylamino)phenyl]-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 131890754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).