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

C18H16N2O4 — CID 897237

IUPAC2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide
SMILESCc1occc1C(=O)Nc1ccccc1NC(=O)c1ccoc1C
InChIInChI=1S/C18H16N2O4/c1-11-13(7-9-23-11)17(21)19-15-5-3-4-6-16(15)20-18(22)14-8-10-24-12(14)2/h3-10H,1-2H3,(H,19,21)(H,20,22)
InChIKeyKVGPOWRCNUQFHY-UHFFFAOYSA-N
MW324.34 g/mol
LogP3.99
Rot. Bonds4

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

2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide (PubChem CID 897237) has the molecular formula C18H16N2O4 and a molecular weight of 324.34 g/mol. Its IUPAC name is 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide
PubChem CID897237
Molecular FormulaC18H16N2O4
Molecular Weight324.34 g/mol
Exact Mass324.11
IUPAC Name2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide
SMILESCc1occc1C(=O)Nc1ccccc1NC(=O)c1ccoc1C
InChIInChI=1S/C18H16N2O4/c1-11-13(7-9-23-11)17(21)19-15-5-3-4-6-16(15)20-18(22)14-8-10-24-12(14)2/h3-10H,1-2H3,(H,19,21)(H,20,22)
InChIKeyKVGPOWRCNUQFHY-UHFFFAOYSA-N
XLogP3.99
TPSA84.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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5-Methyl-furan-3-carboxylic acid (4-methoxy-phenyl)-amide
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2,5-dimethyl-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylfuran-3-carboxamide
CID 25163737
2-methyl-N-[3-(trifluoromethyl)phenyl]furan-3-carboxamide
CID 738837
3-{3-[(2-Methyl-3-furoyl)amino]phenyl}acrylic acid
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N-(2-ethoxyphenyl)-2-methylfuran-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide (CID 897237) is 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide is Cc1occc1C(=O)Nc1ccccc1NC(=O)c1ccoc1C.
What is the InChIKey of 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide?
The InChIKey is KVGPOWRCNUQFHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O4/c1-11-13(7-9-23-11)17(21)19-15-5-3-4-6-16(15)20-18(22)14-8-10-24-12(14)2/h3-10H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide?
2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 3.99, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[(2-methylfuran-3-carbonyl)amino]phenyl]furan-3-carboxamide is sourced from PubChem (CID 897237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).