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

C11H12N2O — CID 15616431

IUPAC(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine
SMILESCc1oc(-c2ccccc2)nc1CN
InChIInChI=1S/C11H12N2O/c1-8-10(7-12)13-11(14-8)9-5-3-2-4-6-9/h2-6H,7,12H2,1H3
InChIKeyLEKZZMAVLLJSNA-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.11
Rot. Bonds2

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

(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine (PubChem CID 15616431) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine.

Molecular Properties

Compound Name(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine
PubChem CID15616431
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine
SMILESCc1oc(-c2ccccc2)nc1CN
InChIInChI=1S/C11H12N2O/c1-8-10(7-12)13-11(14-8)9-5-3-2-4-6-9/h2-6H,7,12H2,1H3
InChIKeyLEKZZMAVLLJSNA-UHFFFAOYSA-N
XLogP2.11
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanamine
CID 46344053
[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1,3-thiazol-2-yl]methanamine
CID 23159284
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetaldehyde
CID 18984662
(5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine
CID 82281196
N'-hydroxy-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethanimidamide
CID 57365509
[2-(2-ethylphenyl)-5-methyl-1,3-oxazol-4-yl]methanamine
CID 170752586
[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanamine;hydrochloride
CID 45156813
N-(1-amino-2-methylpropan-2-yl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 119523291
4-ethyl-5-methyl-2-(3-phenylphenyl)-1,3-oxazole
CID 91508393
[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanamine;hydrochloride
CID 45156819
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 2-methylbenzoate
CID 16588766
[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl-triphenylphosphanium
CID 24742720

Frequently Asked Questions

What is the IUPAC name of (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine?
The IUPAC name of (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine (CID 15616431) is (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine.
What is the SMILES notation for (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine?
The canonical SMILES for (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine is Cc1oc(-c2ccccc2)nc1CN.
What is the InChIKey of (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine?
The InChIKey is LEKZZMAVLLJSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-8-10(7-12)13-11(14-8)9-5-3-2-4-6-9/h2-6H,7,12H2,1H3.
What are the key properties of (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine?
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine has a molecular weight of 188.23 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine is sourced from PubChem (CID 15616431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).