2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine

C10H12N4O — CID 3233386

IUPAC2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine
SMILESCNc1ccnc(-c2c(C)noc2C)n1
InChIInChI=1S/C10H12N4O/c1-6-9(7(2)15-14-6)10-12-5-4-8(11-3)13-10/h4-5H,1-3H3,(H,11,12,13)
InChIKeyLZPIKGXGBFDXOW-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.79
Rot. Bonds2

About 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine (PubChem CID 3233386) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine
PubChem CID3233386
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine
SMILESCNc1ccnc(-c2c(C)noc2C)n1
InChIInChI=1S/C10H12N4O/c1-6-9(7(2)15-14-6)10-12-5-4-8(11-3)13-10/h4-5H,1-3H3,(H,11,12,13)
InChIKeyLZPIKGXGBFDXOW-UHFFFAOYSA-N
XLogP1.79
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine?
The IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine (CID 3233386) is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine is CNc1ccnc(-c2c(C)noc2C)n1.
What is the InChIKey of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine?
The InChIKey is LZPIKGXGBFDXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-6-9(7(2)15-14-6)10-12-5-4-8(11-3)13-10/h4-5H,1-3H3,(H,11,12,13).
What are the key properties of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine?
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine has a molecular weight of 204.23 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 3233386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).