N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide

C23H23N3O4 — CID 6463083

IUPACN-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide
SMILESCN(C(=O)c1cc(NC(=O)c2ccco2)ccc1N1CCOCC1)c1ccccc1
InChIInChI=1S/C23H23N3O4/c1-25(18-6-3-2-4-7-18)23(28)19-16-17(24-22(27)21-8-5-13-30-21)9-10-20(19)26-11-14-29-15-12-26/h2-10,13,16H,11-12,14-15H2,1H3,(H,24,27)
InChIKeyNBIKEUQBGLCXKB-UHFFFAOYSA-N
MW405.45 g/mol
LogP3.65
Rot. Bonds5

About N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide

N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide (PubChem CID 6463083) has the molecular formula C23H23N3O4 and a molecular weight of 405.45 g/mol. Its IUPAC name is N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide
PubChem CID6463083
Molecular FormulaC23H23N3O4
Molecular Weight405.45 g/mol
Exact Mass405.17
IUPAC NameN-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide
SMILESCN(C(=O)c1cc(NC(=O)c2ccco2)ccc1N1CCOCC1)c1ccccc1
InChIInChI=1S/C23H23N3O4/c1-25(18-6-3-2-4-7-18)23(28)19-16-17(24-22(27)21-8-5-13-30-21)9-10-20(19)26-11-14-29-15-12-26/h2-10,13,16H,11-12,14-15H2,1H3,(H,24,27)
InChIKeyNBIKEUQBGLCXKB-UHFFFAOYSA-N
XLogP3.65
TPSA75.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.45
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(3-carbamoyl-4-morpholin-4-ylphenyl)furan-2-carboxamide
CID 886010
N-[3-[benzyl(methyl)carbamoyl]-4-[4-(cyclopentanecarbonyl)piperazin-1-yl]phenyl]furan-2-carboxamide
CID 42673221
N-[3-[3-(dimethylamino)propylcarbamoyl]-4-piperidin-1-ylphenyl]furan-2-carboxamide
CID 42757063
N-[3-[(4-methylphenyl)carbamoyl]-4-piperidin-1-ylphenyl]furan-2-carboxamide
CID 1320461
2-(2,6-dimethylmorpholin-4-yl)-5-(furan-2-carbonylamino)benzoic acid
CID 2804715
4-[2-[benzyl(methyl)carbamoyl]-4-(furan-2-carbonylamino)phenyl]-N-cyclohexylpiperazine-1-carboxamide
CID 42673367
5-[(2-methylbenzoyl)amino]-2-morpholin-4-ylbenzoic acid
CID 50807484
N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-morpholin-4-ylpropylcarbamoyl)phenyl]furan-2-carboxamide
CID 42751474
N-[4-[4-(3-fluorobenzoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl]furan-2-carboxamide
CID 42678329
N-[4-[4-(furan-2-carbonyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]furan-2-carboxamide
CID 42671906
N-[3-[(2-chlorophenyl)sulfamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide
CID 42990181
N-[4-(4-benzylpiperidin-1-yl)-3-(2-methoxyethylcarbamoyl)phenyl]furan-2-carboxamide
CID 4042183

Frequently Asked Questions

What is the IUPAC name of N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide?
The IUPAC name of N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide (CID 6463083) is N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide is CN(C(=O)c1cc(NC(=O)c2ccco2)ccc1N1CCOCC1)c1ccccc1.
What is the InChIKey of N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide?
The InChIKey is NBIKEUQBGLCXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4/c1-25(18-6-3-2-4-7-18)23(28)19-16-17(24-22(27)21-8-5-13-30-21)9-10-20(19)26-11-14-29-15-12-26/h2-10,13,16H,11-12,14-15H2,1H3,(H,24,27).
What are the key properties of N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide?
N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide has a molecular weight of 405.45 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[methyl(phenyl)carbamoyl]-4-morpholin-4-ylphenyl]furan-2-carboxamide is sourced from PubChem (CID 6463083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).