2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine

C11H16N4O — CID 90245533

IUPAC2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
SMILESCc1cc(NC2COC2)nc(N2CCC2)n1
InChIInChI=1S/C11H16N4O/c1-8-5-10(13-9-6-16-7-9)14-11(12-8)15-3-2-4-15/h5,9H,2-4,6-7H2,1H3,(H,12,13,14)
InChIKeyQTZKXEARAMTIMO-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.81
Rot. Bonds3

About 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine

2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine (PubChem CID 90245533) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
PubChem CID90245533
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
SMILESCc1cc(NC2COC2)nc(N2CCC2)n1
InChIInChI=1S/C11H16N4O/c1-8-5-10(13-9-6-16-7-9)14-11(12-8)15-3-2-4-15/h5,9H,2-4,6-7H2,1H3,(H,12,13,14)
InChIKeyQTZKXEARAMTIMO-UHFFFAOYSA-N
XLogP0.81
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-ethylpiperazin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
CID 118549633
1-[4-[4-methyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]propan-1-one
CID 118549624
N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 112912292
1,4-bis(4,6-dimethylpyrimidin-2-yl)-1,4-diazepane
CID 99786904
N-(oxetan-3-yl)-2-piperazin-1-yl-6-propan-2-ylpyrimidin-4-amine
CID 118617228
2-(4-methylpiperazin-1-yl)-6-(oxetan-3-ylamino)pyrimidine-4-carboxylic acid
CID 162458584
N-(azetidin-3-yl)-6-methyl-2-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 90245413
2-[4-(3-chlorophenyl)piperazin-1-yl]-N-cyclopentyl-6-methylpyrimidin-4-amine
CID 112909661
1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]propan-1-one
CID 118546942
methyl 2-(4-methylpiperazin-1-yl)-6-(oxetan-3-ylamino)pyrimidine-4-carboxylate
CID 162458558
N-ethyl-6-methyl-2-piperidin-1-ylpyrimidin-4-amine
CID 62190895
6-methyl-N-(4-piperidin-1-ylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112909558

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine?
The IUPAC name of 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine (CID 90245533) is 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine?
The canonical SMILES for 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine is Cc1cc(NC2COC2)nc(N2CCC2)n1.
What is the InChIKey of 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine?
The InChIKey is QTZKXEARAMTIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-8-5-10(13-9-6-16-7-9)14-11(12-8)15-3-2-4-15/h5,9H,2-4,6-7H2,1H3,(H,12,13,14).
What are the key properties of 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine?
2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine has a molecular weight of 220.28 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 90245533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).