N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide

C21H20N2O4 — CID 55907187

IUPACN-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCc1ccccc1OCCNC(=O)c1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C21H20N2O4/c1-15-6-2-3-9-18(15)27-13-11-22-20(24)16-7-4-8-17(14-16)23-21(25)19-10-5-12-26-19/h2-10,12,14H,11,13H2,1H3,(H,22,24)(H,23,25)
InChIKeyFRYLGQFFVRYCTD-UHFFFAOYSA-N
MW364.40 g/mol
LogP3.65
Rot. Bonds7

About N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide

N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide (PubChem CID 55907187) has the molecular formula C21H20N2O4 and a molecular weight of 364.40 g/mol. Its IUPAC name is N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide
PubChem CID55907187
Molecular FormulaC21H20N2O4
Molecular Weight364.40 g/mol
Exact Mass364.14
IUPAC NameN-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCc1ccccc1OCCNC(=O)c1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C21H20N2O4/c1-15-6-2-3-9-18(15)27-13-11-22-20(24)16-7-4-8-17(14-16)23-21(25)19-10-5-12-26-19/h2-10,12,14H,11,13H2,1H3,(H,22,24)(H,23,25)
InChIKeyFRYLGQFFVRYCTD-UHFFFAOYSA-N
XLogP3.65
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-[[2-[3-(3-methoxypropylcarbamoyl)anilino]-2-oxoethyl]amino]phenyl]furan-2-carboxamide
CID 54843328
N-[3-(2-hydroxypropylcarbamoyl)phenyl]furan-2-carboxamide
CID 78897732
3-[[2-(2-methylphenoxy)acetyl]amino]-N-propylbenzamide
CID 17222626
N-[3-[(3-ethoxyphenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 55844290
N-[3-[(3-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 27244358
N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 17297031
N-[3-[(2-methyl-1,3-thiazol-5-yl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 86836025
N-[3-[2-(2-methoxyethylamino)-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 46547454
N-[3-[(4-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 51179863
N-[3-(2-methoxyethylcarbamoyl)phenyl]-5-[(2-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
CID 46332284
methyl 3-[3-(2-methylphenoxy)propylcarbamoylamino]benzoate
CID 108884001
N-[5-[(3-carbamoylphenyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 78779252

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide (CID 55907187) is N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide is Cc1ccccc1OCCNC(=O)c1cccc(NC(=O)c2ccco2)c1.
What is the InChIKey of N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is FRYLGQFFVRYCTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O4/c1-15-6-2-3-9-18(15)27-13-11-22-20(24)16-7-4-8-17(14-16)23-21(25)19-10-5-12-26-19/h2-10,12,14H,11,13H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide?
N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 364.40 g/mol, XLogP of 3.65, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(2-methylphenoxy)ethylcarbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 55907187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).