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

C10H11N3O — CID 82281196

IUPAC(5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine
SMILESCc1oc(-c2ccccn2)nc1CN
InChIInChI=1S/C10H11N3O/c1-7-9(6-11)13-10(14-7)8-4-2-3-5-12-8/h2-5H,6,11H2,1H3
InChIKeyNJOQAOLMJPDUTI-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.50
Rot. Bonds2

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

(5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine (PubChem CID 82281196) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine.

Molecular Properties

Compound Name(5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine
PubChem CID82281196
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name(5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine
SMILESCc1oc(-c2ccccn2)nc1CN
InChIInChI=1S/C10H11N3O/c1-7-9(6-11)13-10(14-7)8-4-2-3-5-12-8/h2-5H,6,11H2,1H3
InChIKeyNJOQAOLMJPDUTI-UHFFFAOYSA-N
XLogP1.50
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine?
The IUPAC name of (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine (CID 82281196) is (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine.
What is the SMILES notation for (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine?
The canonical SMILES for (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine is Cc1oc(-c2ccccn2)nc1CN.
What is the InChIKey of (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine?
The InChIKey is NJOQAOLMJPDUTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-7-9(6-11)13-10(14-7)8-4-2-3-5-12-8/h2-5H,6,11H2,1H3.
What are the key properties of (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine?
(5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine has a molecular weight of 189.22 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine is sourced from PubChem (CID 82281196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).