N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide

C15H22N2O4 — CID 119723243

IUPACN-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide
SMILESCOCCOc1ccc(CNC(=O)C2COCCN2)cc1
InChIInChI=1S/C15H22N2O4/c1-19-8-9-21-13-4-2-12(3-5-13)10-17-15(18)14-11-20-7-6-16-14/h2-5,14,16H,6-11H2,1H3,(H,17,18)
InChIKeyYTUATAJWIJVELU-UHFFFAOYSA-N
MW294.35 g/mol
LogP0.32
Rot. Bonds7

About N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide

N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide (PubChem CID 119723243) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide
PubChem CID119723243
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC NameN-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide
SMILESCOCCOc1ccc(CNC(=O)C2COCCN2)cc1
InChIInChI=1S/C15H22N2O4/c1-19-8-9-21-13-4-2-12(3-5-13)10-17-15(18)14-11-20-7-6-16-14/h2-5,14,16H,6-11H2,1H3,(H,17,18)
InChIKeyYTUATAJWIJVELU-UHFFFAOYSA-N
XLogP0.32
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.32
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

N-[(4-propoxyphenyl)methyl]morpholine-3-carboxamide
CID 119714341
N-[[4-[3-(dimethylamino)propoxy]phenyl]methyl]morpholine-3-carboxamide
CID 119877252
N-[[4-(methoxymethyl)phenyl]methyl]morpholine-3-carboxamide;hydrochloride
CID 119718110
N-[[4-(2-methoxyethoxy)phenyl]methyl]pyrrolidine-2-carboxamide
CID 119289297
N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide
CID 119289286
N-[2-(4-methoxyphenoxy)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119694151
N-[[4-(2-methoxyethoxy)phenyl]methyl]-1,3-thiazolidine-4-carboxamide
CID 110793789
N-[(4-tert-butylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119707397
N-[3-(4-fluorophenoxy)propyl]morpholine-3-carboxamide
CID 119757179
(3S)-N-(2-methoxyethyl)morpholine-3-carboxamide
CID 96998631
N-[[3-[2-(dimethylamino)ethoxy]phenyl]methyl]morpholine-3-carboxamide
CID 119845730
N-[4-(4-fluorophenoxy)butyl]morpholine-3-carboxamide
CID 119695885

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide?
The IUPAC name of N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide (CID 119723243) is N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide?
The canonical SMILES for N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide is COCCOc1ccc(CNC(=O)C2COCCN2)cc1.
What is the InChIKey of N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide?
The InChIKey is YTUATAJWIJVELU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-19-8-9-21-13-4-2-12(3-5-13)10-17-15(18)14-11-20-7-6-16-14/h2-5,14,16H,6-11H2,1H3,(H,17,18).
What are the key properties of N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide?
N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide has a molecular weight of 294.35 g/mol, XLogP of 0.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide is sourced from PubChem (CID 119723243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).