N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide

C13H17N3O3 — CID 47033018

IUPACN-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide
SMILESCNC(=O)c1ccc(NC(=O)N2CCOCC2)cc1
InChIInChI=1S/C13H17N3O3/c1-14-12(17)10-2-4-11(5-3-10)15-13(18)16-6-8-19-9-7-16/h2-5H,6-9H2,1H3,(H,14,17)(H,15,18)
InChIKeyASIABVOCMCEMRE-UHFFFAOYSA-N
MW263.30 g/mol
LogP0.91
Rot. Bonds2

About N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide

N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide (PubChem CID 47033018) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide
PubChem CID47033018
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC NameN-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide
SMILESCNC(=O)c1ccc(NC(=O)N2CCOCC2)cc1
InChIInChI=1S/C13H17N3O3/c1-14-12(17)10-2-4-11(5-3-10)15-13(18)16-6-8-19-9-7-16/h2-5H,6-9H2,1H3,(H,14,17)(H,15,18)
InChIKeyASIABVOCMCEMRE-UHFFFAOYSA-N
XLogP0.91
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide
CID 110178513
N-methyl-4-[[(2S)-3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl]carbamoylamino]benzamide
CID 95975366
N-(4-cyanophenyl)morpholine-4-carboxamide
CID 4984315
N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide
CID 61341444
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]morpholine-4-carboxamide
CID 110352817
N-[4-(ethylcarbamoyl)phenyl]-4-morpholin-4-ylsulfonylpiperazine-1-carboxamide
CID 55818888
N-[3-(morpholine-4-carbonylamino)phenyl]morpholine-4-carboxamide
CID 171576986
N-(3-acetamidophenyl)morpholine-4-carboxamide
CID 3707113
N-(4-fluorophenyl)-4-[(E)-3-[4-(methylcarbamoyl)phenyl]prop-2-enoyl]piperazine-1-carboxamide
CID 37442444
4-methylsulfanyl-N-[4-(morpholine-4-carbonyl)phenyl]benzamide
CID 78892234
N-[4-(propylaminomethyl)phenyl]morpholine-4-carboxamide
CID 106911473
N-(3,4,5-trifluorophenyl)morpholine-4-carboxamide
CID 115646656

Frequently Asked Questions

What is the IUPAC name of N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide?
The IUPAC name of N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide (CID 47033018) is N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide?
The canonical SMILES for N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide is CNC(=O)c1ccc(NC(=O)N2CCOCC2)cc1.
What is the InChIKey of N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide?
The InChIKey is ASIABVOCMCEMRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c1-14-12(17)10-2-4-11(5-3-10)15-13(18)16-6-8-19-9-7-16/h2-5H,6-9H2,1H3,(H,14,17)(H,15,18).
What are the key properties of N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide?
N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 47033018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).