N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine

C9H13N3O2 — CID 102608806

IUPACN,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine
SMILESCNc1ncnc(OC2COC2)c1C
InChIInChI=1S/C9H13N3O2/c1-6-8(10-2)11-5-12-9(6)14-7-3-13-4-7/h5,7H,3-4H2,1-2H3,(H,10,11,12)
InChIKeyNOJFMXSVCYCNAO-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.60
Rot. Bonds3

About N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine

N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine (PubChem CID 102608806) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine.

Molecular Properties

Compound NameN,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine
PubChem CID102608806
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC NameN,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine
SMILESCNc1ncnc(OC2COC2)c1C
InChIInChI=1S/C9H13N3O2/c1-6-8(10-2)11-5-12-9(6)14-7-3-13-4-7/h5,7H,3-4H2,1-2H3,(H,10,11,12)
InChIKeyNOJFMXSVCYCNAO-UHFFFAOYSA-N
XLogP0.60
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3-ethylcyclohexyl)oxy-N,5-dimethylpyrimidin-4-amine
CID 80876542
N-ethyl-5-methoxy-6-(oxetan-3-yloxy)pyrimidin-4-amine
CID 102608811
4-chloro-5-methoxy-6-(oxetan-3-yloxy)pyrimidine
CID 102606254
N-methyl-5-nitro-6-(oxolan-3-yloxy)pyrimidin-4-amine
CID 80876206
[6-(4,4-dimethylcyclohexyl)oxy-5-methylpyrimidin-4-yl]hydrazine
CID 114343031
6-(2-methoxyethoxy)-N,5-dimethylpyrimidin-4-amine
CID 80859076
[5-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-yl]hydrazine
CID 80920309
N,5-dimethyl-6-(2,3,6-trimethylphenoxy)pyrimidin-4-amine
CID 80875633
N,5-dimethyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine
CID 80860742
6-(4-chlorophenoxy)-N,5-dimethylpyrimidin-4-amine
CID 80864217
N-(2-chloro-4-methylphenyl)-5-methyl-6-(3-oxa-9-azabicyclo[3.3.1]nonan-7-yloxy)pyrimidin-4-amine
CID 58414844
6-(3,5-dimethylcyclohexyl)oxy-N-methyl-5-propan-2-ylpyrimidin-4-amine
CID 80878317

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine?
The IUPAC name of N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine (CID 102608806) is N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine.
What is the SMILES notation for N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine?
The canonical SMILES for N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine is CNc1ncnc(OC2COC2)c1C.
What is the InChIKey of N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine?
The InChIKey is NOJFMXSVCYCNAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-6-8(10-2)11-5-12-9(6)14-7-3-13-4-7/h5,7H,3-4H2,1-2H3,(H,10,11,12).
What are the key properties of N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine?
N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine has a molecular weight of 195.22 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-6-(oxetan-3-yloxy)pyrimidin-4-amine is sourced from PubChem (CID 102608806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).