1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine

C17H24N2O2 — CID 60888210

IUPAC1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine
SMILESCCNC(CC)c1ccc(OCc2c(C)noc2C)cc1
InChIInChI=1S/C17H24N2O2/c1-5-17(18-6-2)14-7-9-15(10-8-14)20-11-16-12(3)19-21-13(16)4/h7-10,17-18H,5-6,11H2,1-4H3
InChIKeyGOLHZDGQZVVTIA-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.93
Rot. Bonds7

About 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine

1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine (PubChem CID 60888210) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine.

Molecular Properties

Compound Name1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine
PubChem CID60888210
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine
SMILESCCNC(CC)c1ccc(OCc2c(C)noc2C)cc1
InChIInChI=1S/C17H24N2O2/c1-5-17(18-6-2)14-7-9-15(10-8-14)20-11-16-12(3)19-21-13(16)4/h7-10,17-18H,5-6,11H2,1-4H3
InChIKeyGOLHZDGQZVVTIA-UHFFFAOYSA-N
XLogP3.93
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-[1-(4-methylphenyl)propyl]acetamide
CID 112766082
(2S)-2-amino-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]ethanol
CID 66515955
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[1-(4-methoxyphenyl)propyl]acetamide
CID 43027694
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-phenylbutyl)benzamide
CID 46533721
N-[[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine
CID 60657484
N-(1-amino-3-methyl-1-oxopentan-2-yl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
CID 78773318
1-[4-[(2-chlorophenyl)methoxy]phenyl]-N-ethylpropan-1-amine
CID 63500455
N-ethyl-1-[4-[(1-methylpyrazol-4-yl)methoxy]phenyl]propan-1-amine
CID 60889160
6-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-ethyl-2,3-dihydro-1-benzofuran-3-amine
CID 63096041
1-[4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]-N-propylpropan-1-amine
CID 60888596
methyl 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-2-methylpropanoate
CID 71247972
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-methoxyacetamide
CID 30796971

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine?
The IUPAC name of 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine (CID 60888210) is 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine.
What is the SMILES notation for 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine?
The canonical SMILES for 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine is CCNC(CC)c1ccc(OCc2c(C)noc2C)cc1.
What is the InChIKey of 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine?
The InChIKey is GOLHZDGQZVVTIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-5-17(18-6-2)14-7-9-15(10-8-14)20-11-16-12(3)19-21-13(16)4/h7-10,17-18H,5-6,11H2,1-4H3.
What are the key properties of 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine?
1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine has a molecular weight of 288.39 g/mol, XLogP of 3.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-ethylpropan-1-amine is sourced from PubChem (CID 60888210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).