N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine

C9H14N4O — CID 66331245

IUPACN-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine
SMILESCOc1cc(NC2CNC2)nc(C)n1
InChIInChI=1S/C9H14N4O/c1-6-11-8(3-9(12-6)14-2)13-7-4-10-5-7/h3,7,10H,4-5H2,1-2H3,(H,11,12,13)
InChIKeySFILQWRIKJHVOE-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.18
Rot. Bonds3

About N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine

N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine (PubChem CID 66331245) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine
PubChem CID66331245
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC NameN-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine
SMILESCOc1cc(NC2CNC2)nc(C)n1
InChIInChI=1S/C9H14N4O/c1-6-11-8(3-9(12-6)14-2)13-7-4-10-5-7/h3,7,10H,4-5H2,1-2H3,(H,11,12,13)
InChIKeySFILQWRIKJHVOE-UHFFFAOYSA-N
XLogP0.18
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-methoxy-2-methylpyrimidin-4-yl)amino]cyclobutan-1-ol
CID 66326324
N-(4,4-dimethylcyclohexyl)-6-methoxy-2-methylpyrimidin-4-amine
CID 66327750
6-methoxy-2-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidin-4-amine
CID 103967188
6-methoxy-2-methyl-N-(4-methylsulfanylcyclohexyl)pyrimidin-4-amine
CID 114123922
N-(azetidin-3-yl)-6-methoxypyrimidin-4-amine
CID 66319421
6-methoxy-N-(6-methoxy-2-methylpyrimidin-4-yl)-2-methylpyrimidin-4-amine
CID 121013131
2-[(6-methoxy-2-methylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 66326095
6-ethoxy-N-[(4S)-4-methoxypyrrolidin-3-yl]-2-methylpyrimidin-4-amine
CID 66332908
4-N-(azetidin-3-yl)-2-methyl-6-N-pyridin-4-ylpyrimidine-4,6-diamine
CID 115266465
N-(azetidin-3-yl)-4-tert-butyl-6-methoxypyrimidin-2-amine
CID 118552350
6-(4-methoxyphenyl)-2-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 82191981
N-(azetidin-3-yl)-6-ethoxypyridin-2-amine
CID 66187269

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine?
The IUPAC name of N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine (CID 66331245) is N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine.
What is the SMILES notation for N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine?
The canonical SMILES for N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine is COc1cc(NC2CNC2)nc(C)n1.
What is the InChIKey of N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine?
The InChIKey is SFILQWRIKJHVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-6-11-8(3-9(12-6)14-2)13-7-4-10-5-7/h3,7,10H,4-5H2,1-2H3,(H,11,12,13).
What are the key properties of N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine?
N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine has a molecular weight of 194.24 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-6-methoxy-2-methylpyrimidin-4-amine is sourced from PubChem (CID 66331245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).