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

C11H14N4O — CID 3233642

IUPAC2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine
SMILESCc1noc(C)c1-c1nccc(N(C)C)n1
InChIInChI=1S/C11H14N4O/c1-7-10(8(2)16-14-7)11-12-6-5-9(13-11)15(3)4/h5-6H,1-4H3
InChIKeyDMOSLHVQHRHPJD-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.81
Rot. Bonds2

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

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine (PubChem CID 3233642) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine
PubChem CID3233642
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine
SMILESCc1noc(C)c1-c1nccc(N(C)C)n1
InChIInChI=1S/C11H14N4O/c1-7-10(8(2)16-14-7)11-12-6-5-9(13-11)15(3)4/h5-6H,1-4H3
InChIKeyDMOSLHVQHRHPJD-UHFFFAOYSA-N
XLogP1.81
TPSA55.05 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.81
H-Bond Donors ≤ 50
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,N-dimethylpyrimidin-4-amine?
The IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine (CID 3233642) is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine?
The canonical SMILES for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine is Cc1noc(C)c1-c1nccc(N(C)C)n1.
What is the InChIKey of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine?
The InChIKey is DMOSLHVQHRHPJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-7-10(8(2)16-14-7)11-12-6-5-9(13-11)15(3)4/h5-6H,1-4H3.
What are the key properties of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine?
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpyrimidin-4-amine has a molecular weight of 218.26 g/mol, XLogP of 1.81, 2 rotatable bonds, 0 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,N-dimethylpyrimidin-4-amine is sourced from PubChem (CID 3233642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).