N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide

C16H18N2O4 — CID 650589

IUPACN-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide
SMILESCOc1cc(NC(=O)C(C)C)ccc1NC(=O)c1ccco1
InChIInChI=1S/C16H18N2O4/c1-10(2)15(19)17-11-6-7-12(14(9-11)21-3)18-16(20)13-5-4-8-22-13/h4-10H,1-3H3,(H,17,19)(H,18,20)
InChIKeyXQYLAZBXHBOISL-UHFFFAOYSA-N
MW302.33 g/mol
LogP3.13
Rot. Bonds5

About N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide

N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide (PubChem CID 650589) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide
PubChem CID650589
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC NameN-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide
SMILESCOc1cc(NC(=O)C(C)C)ccc1NC(=O)c1ccco1
InChIInChI=1S/C16H18N2O4/c1-10(2)15(19)17-11-6-7-12(14(9-11)21-3)18-16(20)13-5-4-8-22-13/h4-10H,1-3H3,(H,17,19)(H,18,20)
InChIKeyXQYLAZBXHBOISL-UHFFFAOYSA-N
XLogP3.13
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylphenyl)furan-2-carboxamide
CID 785196
N-Phenyl-2-furancarboxamide
CID 220406
N-(3-fluorophenyl)furan-2-carboxamide
CID 306831
N-(2-methoxy-5-nitrophenyl)furan-2-carboxamide
CID 710698
N-[4-(diethylamino)phenyl]-2-furancarboxamide
CID 675057
4'-Methoxy-2-furanilide
CID 303388
N-(4-Fluorophenyl)-2-furamide
CID 531893
N-(4-acetamidophenyl)-5-acetylfuran-2-carboxamide
CID 155427942
N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]furan-2-carboxamide
CID 10735128
N-[4-(hexanoylamino)-2-methoxyphenyl]-1-benzofuran-2-carboxamide
CID 1868107
1-(2-Furoyl)-4-(2-methoxyphenyl)piperazine
CID 595810
N-(3,4-difluorophenyl)furan-2-carboxamide
CID 743722

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide (CID 650589) is N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide is COc1cc(NC(=O)C(C)C)ccc1NC(=O)c1ccco1.
What is the InChIKey of N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide?
The InChIKey is XQYLAZBXHBOISL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-10(2)15(19)17-11-6-7-12(14(9-11)21-3)18-16(20)13-5-4-8-22-13/h4-10H,1-3H3,(H,17,19)(H,18,20).
What are the key properties of N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide?
N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 3.13, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-4-(2-methylpropanoylamino)phenyl]furan-2-carboxamide is sourced from PubChem (CID 650589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).