N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride

C14H21ClN2O4 — CID 119679081

IUPACN-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride
SMILESCOc1cc(C)c(NC(=O)C2COCCN2)cc1OC.Cl
InChIInChI=1S/C14H20N2O4.ClH/c1-9-6-12(18-2)13(19-3)7-10(9)16-14(17)11-8-20-5-4-15-11;/h6-7,11,15H,4-5,8H2,1-3H3,(H,16,17);1H
InChIKeyLAMROBUEDXFCCN-UHFFFAOYSA-N
MW316.79 g/mol
LogP1.36
Rot. Bonds4

About N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride

N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119679081) has the molecular formula C14H21ClN2O4 and a molecular weight of 316.79 g/mol. Its IUPAC name is N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride
PubChem CID119679081
Molecular FormulaC14H21ClN2O4
Molecular Weight316.79 g/mol
Exact Mass316.12
IUPAC NameN-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride
SMILESCOc1cc(C)c(NC(=O)C2COCCN2)cc1OC.Cl
InChIInChI=1S/C14H20N2O4.ClH/c1-9-6-12(18-2)13(19-3)7-10(9)16-14(17)11-8-20-5-4-15-11;/h6-7,11,15H,4-5,8H2,1-3H3,(H,16,17);1H
InChIKeyLAMROBUEDXFCCN-UHFFFAOYSA-N
XLogP1.36
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.79
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxy-2,3-dimethylphenyl)morpholine-3-carboxamide
CID 115177555
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
N-(2-methoxy-4,6-dimethylphenyl)morpholine-3-carboxamide
CID 115177560
N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670622
N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119788904
N-(4,5-dimethoxy-2-methylphenyl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119679098
N-(6-chloro-4-methyl-3-pyridinyl)morpholine-3-carboxamide
CID 113266715
N-[(3-methoxy-4-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119747493
N-(4,5-dimethoxy-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679112
N-(3-ethyl-4-methoxyphenyl)morpholine-3-carboxamide
CID 115177545
N-(4,5-dimethoxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide
CID 110792994
N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]morpholine-3-carboxamide
CID 119713511

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride (CID 119679081) is N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride is COc1cc(C)c(NC(=O)C2COCCN2)cc1OC.Cl.
What is the InChIKey of N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is LAMROBUEDXFCCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4.ClH/c1-9-6-12(18-2)13(19-3)7-10(9)16-14(17)11-8-20-5-4-15-11;/h6-7,11,15H,4-5,8H2,1-3H3,(H,16,17);1H.
What are the key properties of N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride?
N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 316.79 g/mol, XLogP of 1.36, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119679081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).