N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide

C22H20N2O4 — CID 46584687

IUPACN-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide
SMILESO=C(NC1CC1)c1ccc(NC(=O)c2ccc(COc3ccccc3)o2)cc1
InChIInChI=1S/C22H20N2O4/c25-21(23-17-10-11-17)15-6-8-16(9-7-15)24-22(26)20-13-12-19(28-20)14-27-18-4-2-1-3-5-18/h1-9,12-13,17H,10-11,14H2,(H,23,25)(H,24,26)
InChIKeyMOIHZDIYTWNTQP-UHFFFAOYSA-N
MW376.41 g/mol
LogP4.00
Rot. Bonds7

About N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide

N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide (PubChem CID 46584687) has the molecular formula C22H20N2O4 and a molecular weight of 376.41 g/mol. Its IUPAC name is N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide
PubChem CID46584687
Molecular FormulaC22H20N2O4
Molecular Weight376.41 g/mol
Exact Mass376.14
IUPAC NameN-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide
SMILESO=C(NC1CC1)c1ccc(NC(=O)c2ccc(COc3ccccc3)o2)cc1
InChIInChI=1S/C22H20N2O4/c25-21(23-17-10-11-17)15-6-8-16(9-7-15)24-22(26)20-13-12-19(28-20)14-27-18-4-2-1-3-5-18/h1-9,12-13,17H,10-11,14H2,(H,23,25)(H,24,26)
InChIKeyMOIHZDIYTWNTQP-UHFFFAOYSA-N
XLogP4.00
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-5-(phenoxymethyl)furan-2-carboxamide
CID 24980847
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 26774462
5-[[4-(cyclohexylcarbamoyl)phenoxy]methyl]furan-2-carboxylic acid
CID 22683768
5-(benzenesulfonylmethyl)-N-[4-(cyclopropylcarbamoyl)phenyl]furan-2-carboxamide
CID 55488951
1-cyclopropyl-3-[[5-(phenoxymethyl)furan-2-carbonyl]amino]urea
CID 36873362
N-cyclopropyl-5-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]furan-2-carboxamide
CID 19455418
N-cyclohexyl-4-(phenoxymethyl)benzamide
CID 40606245
5-[(4-methylphenoxy)methyl]-N-phenylfuran-2-carboxamide
CID 7454734
5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide
CID 19455175
N-(4-acetamidophenyl)-5-[(4-acetylphenoxy)methyl]furan-2-carboxamide
CID 19455187
5-[(4-fluorophenoxy)methyl]-N-(4-phenylphenyl)furan-2-carboxamide
CID 19413095
5-bromo-N-[4-(cyclopropylcarbamoyl)phenyl]furan-2-carboxamide
CID 51299744

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide?
The IUPAC name of N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide (CID 46584687) is N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide is O=C(NC1CC1)c1ccc(NC(=O)c2ccc(COc3ccccc3)o2)cc1.
What is the InChIKey of N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide?
The InChIKey is MOIHZDIYTWNTQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O4/c25-21(23-17-10-11-17)15-6-8-16(9-7-15)24-22(26)20-13-12-19(28-20)14-27-18-4-2-1-3-5-18/h1-9,12-13,17H,10-11,14H2,(H,23,25)(H,24,26).
What are the key properties of N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide?
N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide has a molecular weight of 376.41 g/mol, XLogP of 4.00, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 46584687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).