(2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine

C7H12N2O — CID 82502441

IUPAC(2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine
SMILESCCc1nc(CN)c(C)o1
InChIInChI=1S/C7H12N2O/c1-3-7-9-6(4-8)5(2)10-7/h3-4,8H2,1-2H3
InChIKeyJZYCVDAZFUHLLH-UHFFFAOYSA-N
MW140.19 g/mol
LogP1.00
Rot. Bonds2

About (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine

(2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine (PubChem CID 82502441) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine.

Molecular Properties

Compound Name(2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine
PubChem CID82502441
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name(2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine
SMILESCCc1nc(CN)c(C)o1
InChIInChI=1S/C7H12N2O/c1-3-7-9-6(4-8)5(2)10-7/h3-4,8H2,1-2H3
InChIKeyJZYCVDAZFUHLLH-UHFFFAOYSA-N
XLogP1.00
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 ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-methyl-2-(2-methylpropyl)-1,3-oxazol-4-yl]methanamine
CID 82503114
4-(azetidin-3-ylmethyl)-2-ethyl-5-methyl-1,3-oxazole
CID 105438841
(2-ethyl-4-methyl-1,3-oxazol-5-yl)methanamine;hydrochloride
CID 119031976
[2-(2-ethylphenyl)-5-methyl-1,3-oxazol-4-yl]methanamine
CID 170752586
(2-cyclopropyl-5-methyl-1,3-oxazol-4-yl)methanamine;dihydrochloride
CID 155822451
[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanamine
CID 46344053
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine
CID 15616431
(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-5-yl)methanamine
CID 84655982
(2-cycloheptyl-5-methyl-1,3-oxazol-4-yl)methanamine
CID 82507667
(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)methanamine
CID 84655981
(4-tert-butyl-5-methyl-1,3-oxazol-2-yl)methanamine
CID 105433844
(5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine
CID 82281196

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine?
The IUPAC name of (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine (CID 82502441) is (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine.
What is the SMILES notation for (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine?
The canonical SMILES for (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine is CCc1nc(CN)c(C)o1.
What is the InChIKey of (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine?
The InChIKey is JZYCVDAZFUHLLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-3-7-9-6(4-8)5(2)10-7/h3-4,8H2,1-2H3.
What are the key properties of (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine?
(2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine has a molecular weight of 140.19 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-5-methyl-1,3-oxazol-4-yl)methanamine is sourced from PubChem (CID 82502441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).