1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine

C10H18N2O2 — CID 115712416

IUPAC1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine
SMILESCCOCC(C)NCc1cc(C)on1
InChIInChI=1S/C10H18N2O2/c1-4-13-7-8(2)11-6-10-5-9(3)14-12-10/h5,8,11H,4,6-7H2,1-3H3
InChIKeyMVXDZIUIKYATEH-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.50
Rot. Bonds6

About 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine

1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine (PubChem CID 115712416) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine
PubChem CID115712416
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine
SMILESCCOCC(C)NCc1cc(C)on1
InChIInChI=1S/C10H18N2O2/c1-4-13-7-8(2)11-6-10-5-9(3)14-12-10/h5,8,11H,4,6-7H2,1-3H3
InChIKeyMVXDZIUIKYATEH-UHFFFAOYSA-N
XLogP1.50
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-[1-(oxolan-2-yl)ethyl]-1,2-oxazole-3-carboxamide
CID 2970309
methyl N-(5-methyl-1,2-oxazole-3-carbonyl)glycinate
CID 2747412
1,1,1-Trifluoro-3-[(5-methyl-1,2-oxazol-3-yl)methylamino]propan-2-ol
CID 2738631
3-methyl-N-(propan-2-yl)-1,2-oxazole-5-carboxamide
CID 3245069
N-(sec-butyl)-3-methylisoxazole-5-carboxamide
CID 9551511
Isoxazole, 5-methyl-3-(piperidinomethyl)-, hydrochloride
CID 13673
((2S,4S)-4-fluoro-1-((3-methyl-1,2-oxazol-5-yl)methyl)pyrrolidin-2-yl)methanamine
CID 119030869
Methyl((5-methyl-1,2-oxazol-3-yl)methyl)amine
CID 23006273
Methyl[(3-methyl-1,2-oxazol-5-yl)methyl]amine hydrochloride
CID 45595353
3-methyl-N-[2-(morpholin-4-yl)ethyl]-1,2-oxazole-5-carboxamide
CID 17095595
3-Cyclopentyl-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 38236095
3-(1-Methoxypropan-2-yl)-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 53505826

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine?
The IUPAC name of 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine (CID 115712416) is 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine.
What is the SMILES notation for 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine?
The canonical SMILES for 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine is CCOCC(C)NCc1cc(C)on1.
What is the InChIKey of 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine?
The InChIKey is MVXDZIUIKYATEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-4-13-7-8(2)11-6-10-5-9(3)14-12-10/h5,8,11H,4,6-7H2,1-3H3.
What are the key properties of 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine?
1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine has a molecular weight of 198.27 g/mol, XLogP of 1.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-2-amine is sourced from PubChem (CID 115712416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).