6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine

C14H19N5O — CID 3232687

IUPAC6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine
SMILESCc1noc(C)c1-c1cc(NC2CCNCC2)ncn1
InChIInChI=1S/C14H19N5O/c1-9-14(10(2)20-19-9)12-7-13(17-8-16-12)18-11-3-5-15-6-4-11/h7-8,11,15H,3-6H2,1-2H3,(H,16,17,18)
InChIKeyPXZSTAPFJCXPGK-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.91
Rot. Bonds3

About 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine

6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine (PubChem CID 3232687) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine
PubChem CID3232687
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine
SMILESCc1noc(C)c1-c1cc(NC2CCNCC2)ncn1
InChIInChI=1S/C14H19N5O/c1-9-14(10(2)20-19-9)12-7-13(17-8-16-12)18-11-3-5-15-6-4-11/h7-8,11,15H,3-6H2,1-2H3,(H,16,17,18)
InChIKeyPXZSTAPFJCXPGK-UHFFFAOYSA-N
XLogP1.91
TPSA75.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(5-Methyl-3-phenylisoxazol-4-yl)pyrimidin-2-amine
CID 2745721
N-[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrimidin-2-yl]acetamide
CID 2745748
2-Pyrimidinamine, N-cyclohexyl-4-[3-phenyl-5-(1-piperidinylmethyl)-4-isoxazolyl]-
CID 10093433
N'-[[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-phenylazanyl-pyrimidin-2-yl]phenyl]methyl]-N-methyl-ethane-1,2-diamine
CID 146188223
N'-[[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(oxan-4-ylamino)pyrimidin-2-yl]phenyl]methyl]-N-methyl-ethane-1,2-diamine
CID 146188292
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)pyrimidin-4-amine
CID 3233155
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 3233314
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2-methoxyphenyl)methyl]pyrimidin-4-amine
CID 3233966
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 3234353
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine
CID 3235220
5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpyrimidin-4-amine
CID 3235572
N-[4-[[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrimidin-2-yl]amino]cyclohexyl]acetamide
CID 145986724

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine?
The IUPAC name of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine (CID 3232687) is 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine?
The canonical SMILES for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine is Cc1noc(C)c1-c1cc(NC2CCNCC2)ncn1.
What is the InChIKey of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine?
The InChIKey is PXZSTAPFJCXPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-9-14(10(2)20-19-9)12-7-13(17-8-16-12)18-11-3-5-15-6-4-11/h7-8,11,15H,3-6H2,1-2H3,(H,16,17,18).
What are the key properties of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine?
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-piperidin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 3232687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).