N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride

C13H19ClN2O2 — CID 119670622

IUPACN-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2COCCN2)cc1C.Cl
InChIInChI=1S/C13H18N2O2.ClH/c1-9-3-4-11(7-10(9)2)15-13(16)12-8-17-6-5-14-12;/h3-4,7,12,14H,5-6,8H2,1-2H3,(H,15,16);1H
InChIKeyCJVFPFYNSXQMPW-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.65
Rot. Bonds2

About N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride

N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119670622) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
PubChem CID119670622
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC NameN-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2COCCN2)cc1C.Cl
InChIInChI=1S/C13H18N2O2.ClH/c1-9-3-4-11(7-10(9)2)15-13(16)12-8-17-6-5-14-12;/h3-4,7,12,14H,5-6,8H2,1-2H3,(H,15,16);1H
InChIKeyCJVFPFYNSXQMPW-UHFFFAOYSA-N
XLogP1.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(dimethylamino)-4-methylphenyl]morpholine-3-carboxamide
CID 115377301
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
N-[4-methyl-3-(phenylsulfamoyl)phenyl]morpholine-3-carboxamide
CID 119730948
N-[3-methyl-4-(2,2,2-trifluoroethoxy)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119794822
N-[4-(2-methylpropanoylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119685241
N-(2-methyl-3H-benzimidazol-5-yl)morpholine-3-carboxamide;dihydrochloride
CID 119838375
N-[4-methyl-3-[(4-methyl-2-pyridinyl)oxy]phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119891518
N-(3-ethyl-4-methoxyphenyl)morpholine-3-carboxamide
CID 115177545
N-[3-(cyclopropanecarbonylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119710451
N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]morpholine-3-carboxamide
CID 119675117
N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride
CID 119864469

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride (CID 119670622) is N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride is Cc1ccc(NC(=O)C2COCCN2)cc1C.Cl.
What is the InChIKey of N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is CJVFPFYNSXQMPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2.ClH/c1-9-3-4-11(7-10(9)2)15-13(16)12-8-17-6-5-14-12;/h3-4,7,12,14H,5-6,8H2,1-2H3,(H,15,16);1H.
What are the key properties of N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride?
N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 270.76 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119670622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).