2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine

C16H24N4O — CID 62915666

IUPAC2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2c(C)noc2C)nc(C)c1C(C)C
InChIInChI=1S/C16H24N4O/c1-7-8-17-15-13(9(2)3)10(4)18-16(19-15)14-11(5)20-21-12(14)6/h9H,7-8H2,1-6H3,(H,17,18,19)
InChIKeySOYRRGQSYVGOCM-UHFFFAOYSA-N
MW288.39 g/mol
LogP4.00
Rot. Bonds5

About 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine

2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine (PubChem CID 62915666) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
PubChem CID62915666
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2c(C)noc2C)nc(C)c1C(C)C
InChIInChI=1S/C16H24N4O/c1-7-8-17-15-13(9(2)3)10(4)18-16(19-15)14-11(5)20-21-12(14)6/h9H,7-8H2,1-6H3,(H,17,18,19)
InChIKeySOYRRGQSYVGOCM-UHFFFAOYSA-N
XLogP4.00
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 54.00
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)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine (CID 62915666) is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine is CCCNc1nc(-c2c(C)noc2C)nc(C)c1C(C)C.
What is the InChIKey of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine?
The InChIKey is SOYRRGQSYVGOCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-7-8-17-15-13(9(2)3)10(4)18-16(19-15)14-11(5)20-21-12(14)6/h9H,7-8H2,1-6H3,(H,17,18,19).
What are the key properties of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine?
2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine has a molecular weight of 288.39 g/mol, XLogP of 4.00, 5 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)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 62915666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).