N-(2,4-dimethylphenyl)morpholine-4-carboxamide

C13H18N2O2 — CID 2306921

IUPACN-(2,4-dimethylphenyl)morpholine-4-carboxamide
SMILESCc1ccc(NC(=O)N2CCOCC2)c(C)c1
InChIInChI=1S/C13H18N2O2/c1-10-3-4-12(11(2)9-10)14-13(16)15-5-7-17-8-6-15/h3-4,9H,5-8H2,1-2H3,(H,14,16)
InChIKeyWUMMSECJLPPSPP-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.17
Rot. Bonds1

About N-(2,4-dimethylphenyl)morpholine-4-carboxamide

N-(2,4-dimethylphenyl)morpholine-4-carboxamide (PubChem CID 2306921) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)morpholine-4-carboxamide
PubChem CID2306921
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-(2,4-dimethylphenyl)morpholine-4-carboxamide
SMILESCc1ccc(NC(=O)N2CCOCC2)c(C)c1
InChIInChI=1S/C13H18N2O2/c1-10-3-4-12(11(2)9-10)14-13(16)15-5-7-17-8-6-15/h3-4,9H,5-8H2,1-2H3,(H,14,16)
InChIKeyWUMMSECJLPPSPP-UHFFFAOYSA-N
XLogP2.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(2,4-dimethylphenyl)morpholine-4-carboxamide (CID 2306921) is N-(2,4-dimethylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(2,4-dimethylphenyl)morpholine-4-carboxamide is Cc1ccc(NC(=O)N2CCOCC2)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)morpholine-4-carboxamide?
The InChIKey is WUMMSECJLPPSPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-10-3-4-12(11(2)9-10)14-13(16)15-5-7-17-8-6-15/h3-4,9H,5-8H2,1-2H3,(H,14,16).
What are the key properties of N-(2,4-dimethylphenyl)morpholine-4-carboxamide?
N-(2,4-dimethylphenyl)morpholine-4-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 2306921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).