2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine

C7H12N2O — CID 82594169

IUPAC2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine
SMILESCC(C)(N)Cc1cnco1
InChIInChI=1S/C7H12N2O/c1-7(2,8)3-6-4-9-5-10-6/h4-5H,3,8H2,1-2H3
InChIKeyZJGXUOFFQOWUIW-UHFFFAOYSA-N
MW140.19 g/mol
LogP0.95
Rot. Bonds2

About 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine

2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine (PubChem CID 82594169) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine
PubChem CID82594169
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine
SMILESCC(C)(N)Cc1cnco1
InChIInChI=1S/C7H12N2O/c1-7(2,8)3-6-4-9-5-10-6/h4-5H,3,8H2,1-2H3
InChIKeyZJGXUOFFQOWUIW-UHFFFAOYSA-N
XLogP0.95
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;5-ethyl-1,3-oxazole
CID 142253106
2-(1,3-oxazol-5-yl)propan-2-amine
CID 82593655
5-(6,6-dimethylheptyl)-1,3-oxazole
CID 59842159
N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine
CID 82593723
5-butyl-1,3-oxazole
CID 18000835
5-(ethylsulfonylmethyl)-1,3-oxazole
CID 117192206
5-(3-methylnonan-3-yloxymethyl)-1,3-oxazole
CID 139320118
N-(1,3-oxazol-5-ylmethyl)propan-2-amine
CID 58786923
2-(4-tert-butylphenyl)-2-methyl-N-(1,3-oxazol-5-ylmethyl)propan-1-amine
CID 167826849
1,1-difluoro-3-(1,3-oxazol-5-yl)propan-2-ol
CID 89310136
4-(1,3-oxazol-5-yl)butan-2-one
CID 69229918
4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol
CID 106349259

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine?
The IUPAC name of 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine (CID 82594169) is 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine.
What is the SMILES notation for 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine?
The canonical SMILES for 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine is CC(C)(N)Cc1cnco1.
What is the InChIKey of 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine?
The InChIKey is ZJGXUOFFQOWUIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-7(2,8)3-6-4-9-5-10-6/h4-5H,3,8H2,1-2H3.
What are the key properties of 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine?
2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine has a molecular weight of 140.19 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(1,3-oxazol-5-yl)propan-2-amine is sourced from PubChem (CID 82594169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).