2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine

C10H16N4O — CID 82736361

IUPAC2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine
SMILESCc1nc(N)cc(NC2CCOC2C)n1
InChIInChI=1S/C10H16N4O/c1-6-8(3-4-15-6)14-10-5-9(11)12-7(2)13-10/h5-6,8H,3-4H2,1-2H3,(H3,11,12,13,14)
InChIKeyDIPYECPXHXUAPM-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.96
Rot. Bonds2

About 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine

2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine (PubChem CID 82736361) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine
PubChem CID82736361
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine
SMILESCc1nc(N)cc(NC2CCOC2C)n1
InChIInChI=1S/C10H16N4O/c1-6-8(3-4-15-6)14-10-5-9(11)12-7(2)13-10/h5-6,8H,3-4H2,1-2H3,(H3,11,12,13,14)
InChIKeyDIPYECPXHXUAPM-UHFFFAOYSA-N
XLogP0.96
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine?
The IUPAC name of 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine (CID 82736361) is 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine.
What is the SMILES notation for 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine?
The canonical SMILES for 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine is Cc1nc(N)cc(NC2CCOC2C)n1.
What is the InChIKey of 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine?
The InChIKey is DIPYECPXHXUAPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-6-8(3-4-15-6)14-10-5-9(11)12-7(2)13-10/h5-6,8H,3-4H2,1-2H3,(H3,11,12,13,14).
What are the key properties of 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine?
2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine has a molecular weight of 208.26 g/mol, XLogP of 0.96, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine is sourced from PubChem (CID 82736361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).