N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride

C15H23ClN2O5 — CID 119723387

IUPACN-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCOCCOc1cc(NC(=O)C2CNCCO2)ccc1OC.Cl
InChIInChI=1S/C15H22N2O5.ClH/c1-19-7-8-22-13-9-11(3-4-12(13)20-2)17-15(18)14-10-16-5-6-21-14;/h3-4,9,14,16H,5-8,10H2,1-2H3,(H,17,18);1H
InChIKeyIPEQFVCISNLYGG-UHFFFAOYSA-N
MW346.81 g/mol
LogP1.07
Rot. Bonds7

About N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride

N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119723387) has the molecular formula C15H23ClN2O5 and a molecular weight of 346.81 g/mol. Its IUPAC name is N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119723387
Molecular FormulaC15H23ClN2O5
Molecular Weight346.81 g/mol
Exact Mass346.13
IUPAC NameN-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCOCCOc1cc(NC(=O)C2CNCCO2)ccc1OC.Cl
InChIInChI=1S/C15H22N2O5.ClH/c1-19-7-8-22-13-9-11(3-4-12(13)20-2)17-15(18)14-10-16-5-6-21-14;/h3-4,9,14,16H,5-8,10H2,1-2H3,(H,17,18);1H
InChIKeyIPEQFVCISNLYGG-UHFFFAOYSA-N
XLogP1.07
TPSA78.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.81
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]morpholine-2-carboxamide;dihydrochloride
CID 119865052
N-(4-ethoxy-3-fluorophenyl)morpholine-2-carboxamide;hydrochloride
CID 119742216
N-[4-(2-methoxyethoxy)-2-methylphenyl]morpholine-2-carboxamide;hydrochloride
CID 119723519
N-(2,5-dimethoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119674283
N-(3-methoxy-4-pyrrolidin-1-ylsulfonylphenyl)morpholine-2-carboxamide
CID 119790367
N-(5-bromo-2-methoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119729353
N-(2,4,5-trimethoxyphenyl)morpholine-2-carboxamide
CID 119808138
N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
N-(3-butoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119745760
N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119709306
N-(4,5-dimethoxy-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679112
N-quinoxalin-6-ylmorpholine-2-carboxamide;hydrochloride
CID 119708415

Frequently Asked Questions

What is the IUPAC name of N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride (CID 119723387) is N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride is COCCOc1cc(NC(=O)C2CNCCO2)ccc1OC.Cl.
What is the InChIKey of N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is IPEQFVCISNLYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O5.ClH/c1-19-7-8-22-13-9-11(3-4-12(13)20-2)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-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride?
N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 346.81 g/mol, XLogP of 1.07, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methoxy-3-(2-methoxyethoxy)phenyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119723387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).