N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide

C14H18N2O4 — CID 71370344

IUPACN-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide
SMILESO=C(Nc1ccc(OCC2CO2)cc1)N1CCOCC1
InChIInChI=1S/C14H18N2O4/c17-14(16-5-7-18-8-6-16)15-11-1-3-12(4-2-11)19-9-13-10-20-13/h1-4,13H,5-10H2,(H,15,17)
InChIKeyUCYVOPKVSOBYLZ-UHFFFAOYSA-N
MW278.31 g/mol
LogP1.33
Rot. Bonds4

About N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide

N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide (PubChem CID 71370344) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide
PubChem CID71370344
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC NameN-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide
SMILESO=C(Nc1ccc(OCC2CO2)cc1)N1CCOCC1
InChIInChI=1S/C14H18N2O4/c17-14(16-5-7-18-8-6-16)15-11-1-3-12(4-2-11)19-9-13-10-20-13/h1-4,13H,5-10H2,(H,15,17)
InChIKeyUCYVOPKVSOBYLZ-UHFFFAOYSA-N
XLogP1.33
TPSA63.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

N-[4-[[(2S)-oxiran-2-yl]methoxy]phenyl]acetamide
CID 737230
molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide
CID 143052664
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]thiomorpholine-4-carboxamide
CID 118776743
1-[[4-(oxolan-2-ylmethoxy)phenyl]carbamoyl]piperidine-3-carboxylic acid
CID 122076597
N-(4-cyanophenyl)morpholine-4-carboxamide
CID 4984315
(2S)-2-methyl-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-1,4-oxazepane-4-carboxamide
CID 125155597
N-[4-(2-methoxyethoxy)phenyl]-4-morpholin-4-ylsulfonylpiperazine-1-carboxamide
CID 55697487
N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 94148337
1,3-bis[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]urea
CID 41436663
(2S)-2-[[4-[[(2S)-oxiran-2-yl]methoxy]phenoxy]methyl]oxirane
CID 677176
N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide
CID 47033018
N-[4-(oxolan-2-ylmethoxy)phenyl]-4-pyridazin-3-ylpiperazine-1-carboxamide
CID 134813193

Frequently Asked Questions

What is the IUPAC name of N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide?
The IUPAC name of N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide (CID 71370344) is N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide?
The canonical SMILES for N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide is O=C(Nc1ccc(OCC2CO2)cc1)N1CCOCC1.
What is the InChIKey of N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide?
The InChIKey is UCYVOPKVSOBYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c17-14(16-5-7-18-8-6-16)15-11-1-3-12(4-2-11)19-9-13-10-20-13/h1-4,13H,5-10H2,(H,15,17).
What are the key properties of N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide?
N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide has a molecular weight of 278.31 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(oxiran-2-ylmethoxy)phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 71370344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).