4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine

C15H20N2O2 — CID 57183799

IUPAC4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine
SMILESCc1ccc(C2=CC(CN3CCOCC3)ON2)cc1
InChIInChI=1S/C15H20N2O2/c1-12-2-4-13(5-3-12)15-10-14(19-16-15)11-17-6-8-18-9-7-17/h2-5,10,14,16H,6-9,11H2,1H3
InChIKeyYEUYATBYMPVGLO-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.57
Rot. Bonds3

About 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine

4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine (PubChem CID 57183799) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine
PubChem CID57183799
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine
SMILESCc1ccc(C2=CC(CN3CCOCC3)ON2)cc1
InChIInChI=1S/C15H20N2O2/c1-12-2-4-13(5-3-12)15-10-14(19-16-15)11-17-6-8-18-9-7-17/h2-5,10,14,16H,6-9,11H2,1H3
InChIKeyYEUYATBYMPVGLO-UHFFFAOYSA-N
XLogP1.57
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(1E)-1-phenylprop-1-en-1-yl]morpholine
CID 6370493
{4-[(4-Methylphenyl)methyl]morpholin-2-yl}methanamine
CID 24262371
4-[(Z)-1-phenylprop-1-enyl]morpholine
CID 5384000
4-[(E)-1-phenylpent-1-enyl]morpholine
CID 67716423
4-[(4-Methylphenyl)methyl]-4-oxidomorpholin-4-ium
CID 88948351
4-[[3-[4-(Trifluoromethyl)phenyl]-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine
CID 56999532
(E)-1-[4-[[(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrol-1-yl]methyl]-3-fluorophenyl]-N-(oxan-4-yloxy)prop-1-en-1-amine
CID 129238658
4-[(E)-1-phenylbut-1-enyl]morpholine
CID 134992637
[4-[(2,5-Dimethylmorpholin-4-yl)methyl]-3-fluorophenyl]methanamine
CID 43544261
N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine
CID 117353428
1-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-N-methoxymethanamine
CID 117389175
4-(1-Phenylprop-1-enyl)morpholine
CID 306100

Frequently Asked Questions

What is the IUPAC name of 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine?
The IUPAC name of 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine (CID 57183799) is 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine.
What is the SMILES notation for 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine?
The canonical SMILES for 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine is Cc1ccc(C2=CC(CN3CCOCC3)ON2)cc1.
What is the InChIKey of 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine?
The InChIKey is YEUYATBYMPVGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-12-2-4-13(5-3-12)15-10-14(19-16-15)11-17-6-8-18-9-7-17/h2-5,10,14,16H,6-9,11H2,1H3.
What are the key properties of 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine?
4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine has a molecular weight of 260.34 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-(4-methylphenyl)-2,5-dihydro-1,2-oxazol-5-yl]methyl]morpholine is sourced from PubChem (CID 57183799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).