N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride

C15H23ClN2O4 — CID 119723519

IUPACN-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride
SMILESCOCCOc1ccc(NC(=O)C2CNCCO2)c(C)c1.Cl
InChIInChI=1S/C15H22N2O4.ClH/c1-11-9-12(20-8-7-19-2)3-4-13(11)17-15(18)14-10-16-5-6-21-14;/h3-4,9,14,16H,5-8,10H2,1-2H3,(H,17,18);1H
InChIKeyZQFCYUOLNZPUDV-UHFFFAOYSA-N
MW330.81 g/mol
LogP1.37
Rot. Bonds6

About N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride

N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119723519) has the molecular formula C15H23ClN2O4 and a molecular weight of 330.81 g/mol. Its IUPAC name is N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119723519
Molecular FormulaC15H23ClN2O4
Molecular Weight330.81 g/mol
Exact Mass330.13
IUPAC NameN-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride
SMILESCOCCOc1ccc(NC(=O)C2CNCCO2)c(C)c1.Cl
InChIInChI=1S/C15H22N2O4.ClH/c1-11-9-12(20-8-7-19-2)3-4-13(11)17-15(18)14-10-16-5-6-21-14;/h3-4,9,14,16H,5-8,10H2,1-2H3,(H,17,18);1H
InChIKeyZQFCYUOLNZPUDV-UHFFFAOYSA-N
XLogP1.37
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.81
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

methyl 2-[3-methyl-4-(morpholine-2-carbonylamino)phenoxy]acetate
CID 119742541
N-[4-(2-methoxyethoxy)-2-methylphenyl]piperidine-4-carboxamide;hydrochloride
CID 119289436
N-(4-chloro-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119671690
N-(4,5-dimethoxy-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679112
N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119723387
N-(3-butoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119745760
N-(2,5-dimethoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119674283
N-(2-methyl-4-propoxyphenyl)pyrrolidine-3-carboxamide
CID 119739476
N-(4-methoxy-2,3-dimethylphenyl)morpholine-2-carboxamide
CID 115177389
N-(2-fluoro-4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119675290
N-(4-butan-2-ylsulfanyl-2-methylphenyl)morpholine-2-carboxamide
CID 119758954
N-(2,4,5-trimethoxyphenyl)morpholine-2-carboxamide
CID 119808138

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride (CID 119723519) is N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride is COCCOc1ccc(NC(=O)C2CNCCO2)c(C)c1.Cl.
What is the InChIKey of N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is ZQFCYUOLNZPUDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4.ClH/c1-11-9-12(20-8-7-19-2)3-4-13(11)17-15(18)14-10-16-5-6-21-14;/h3-4,9,14,16H,5-8,10H2,1-2H3,(H,17,18);1H.
What are the key properties of N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride?
N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 330.81 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119723519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).