[5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine

C13H16N2O — CID 105470035

IUPAC[5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine
SMILESCCc1oc(CN)nc1-c1ccccc1C
InChIInChI=1S/C13H16N2O/c1-3-11-13(15-12(8-14)16-11)10-7-5-4-6-9(10)2/h4-7H,3,8,14H2,1-2H3
InChIKeyQFJVWOIOEJWNJT-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.67
Rot. Bonds3

About [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine

[5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine (PubChem CID 105470035) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine
PubChem CID105470035
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name[5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine
SMILESCCc1oc(CN)nc1-c1ccccc1C
InChIInChI=1S/C13H16N2O/c1-3-11-13(15-12(8-14)16-11)10-7-5-4-6-9(10)2/h4-7H,3,8,14H2,1-2H3
InChIKeyQFJVWOIOEJWNJT-UHFFFAOYSA-N
XLogP2.67
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dimethyl-5-(2-methylphenyl)imidazol-4-amine
CID 62225946
4-(5-tert-butyl-2-methylphenyl)-5-ethyl-1,3-oxazol-2-amine
CID 116831894
[2-(aminomethyl)-4-methyl-1,3-oxazol-5-yl]methanamine
CID 68802787
[6-(2-methylphenyl)-2-pyridinyl]methanamine
CID 82505844
5-ethyl-4-(2-hydroxyphenyl)-1,3-oxazole-2-carboxylic acid
CID 105492203
[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
CID 82079249
2-methyl-4-(2-methylphenyl)pyrimidin-5-amine
CID 82374855
[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]methanamine;hydrochloride
CID 82021867
2-[4,6-diethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethanamine
CID 79218553
[5-(2,5-dimethylphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
CID 82078799
2-[1-methyl-2-(2-methylphenyl)imidazol-4-yl]ethanamine
CID 82284699
ethanamine;1,2-xylene
CID 160781195

Frequently Asked Questions

What is the IUPAC name of [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine (CID 105470035) is [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine is CCc1oc(CN)nc1-c1ccccc1C.
What is the InChIKey of [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine?
The InChIKey is QFJVWOIOEJWNJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-3-11-13(15-12(8-14)16-11)10-7-5-4-6-9(10)2/h4-7H,3,8,14H2,1-2H3.
What are the key properties of [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine?
[5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine has a molecular weight of 216.28 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-ethyl-4-(2-methylphenyl)-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 105470035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).