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

C13H19ClN2O4 — CID 119673632

IUPACN-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
SMILESCOc1ccc(NC(=O)C2COCCN2)cc1OC.Cl
InChIInChI=1S/C13H18N2O4.ClH/c1-17-11-4-3-9(7-12(11)18-2)15-13(16)10-8-19-6-5-14-10;/h3-4,7,10,14H,5-6,8H2,1-2H3,(H,15,16);1H
InChIKeyJXAJCAAHYTUXLL-UHFFFAOYSA-N
MW302.76 g/mol
LogP1.05
Rot. Bonds4

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

N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119673632) has the molecular formula C13H19ClN2O4 and a molecular weight of 302.76 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
PubChem CID119673632
Molecular FormulaC13H19ClN2O4
Molecular Weight302.76 g/mol
Exact Mass302.10
IUPAC NameN-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
SMILESCOc1ccc(NC(=O)C2COCCN2)cc1OC.Cl
InChIInChI=1S/C13H18N2O4.ClH/c1-17-11-4-3-9(7-12(11)18-2)15-13(16)10-8-19-6-5-14-10;/h3-4,7,10,14H,5-6,8H2,1-2H3,(H,15,16);1H
InChIKeyJXAJCAAHYTUXLL-UHFFFAOYSA-N
XLogP1.05
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-ethyl-4-methoxyphenyl)morpholine-3-carboxamide
CID 115177545
N-[3-[2-(cyclopropylamino)-2-oxoethoxy]-4-methoxyphenyl]morpholine-3-carboxamide;hydrochloride
CID 119717546
N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670622
N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119679081
(2S)-N-(3,4-dimethoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 119673647
N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]morpholine-3-carboxamide
CID 119739633
N-(4-ethoxy-3-fluorophenyl)morpholine-3-carboxamide
CID 112701655
N-(4-methoxy-2,3-dimethylphenyl)morpholine-3-carboxamide
CID 115177555
methyl 2-chloro-4-(morpholine-3-carbonylamino)benzoate
CID 119794095
N-(3,4-dimethoxyphenyl)azepane-2-carboxamide
CID 64562794
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
N-[3-chloro-4-(difluoromethoxy)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119676727

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride (CID 119673632) is N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride is COc1ccc(NC(=O)C2COCCN2)cc1OC.Cl.
What is the InChIKey of N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is JXAJCAAHYTUXLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4.ClH/c1-17-11-4-3-9(7-12(11)18-2)15-13(16)10-8-19-6-5-14-10;/h3-4,7,10,14H,5-6,8H2,1-2H3,(H,15,16);1H.
What are the key properties of N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride?
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 302.76 g/mol, XLogP of 1.05, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119673632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).