5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine

C10H16N4O — CID 91143171

IUPAC5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine
SMILESCc1nc(N)nc(NC2CCOC2)c1C
InChIInChI=1S/C10H16N4O/c1-6-7(2)12-10(11)14-9(6)13-8-3-4-15-5-8/h8H,3-5H2,1-2H3,(H3,11,12,13,14)
InChIKeySGTRWOLGKHLPLB-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.88
Rot. Bonds2

About 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine

5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine (PubChem CID 91143171) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine
PubChem CID91143171
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine
SMILESCc1nc(N)nc(NC2CCOC2)c1C
InChIInChI=1S/C10H16N4O/c1-6-7(2)12-10(11)14-9(6)13-8-3-4-15-5-8/h8H,3-5H2,1-2H3,(H3,11,12,13,14)
InChIKeySGTRWOLGKHLPLB-UHFFFAOYSA-N
XLogP0.88
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 ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine?
The IUPAC name of 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine (CID 91143171) is 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine.
What is the SMILES notation for 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine?
The canonical SMILES for 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine is Cc1nc(N)nc(NC2CCOC2)c1C.
What is the InChIKey of 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine?
The InChIKey is SGTRWOLGKHLPLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-6-7(2)12-10(11)14-9(6)13-8-3-4-15-5-8/h8H,3-5H2,1-2H3,(H3,11,12,13,14).
What are the key properties of 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine?
5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine has a molecular weight of 208.26 g/mol, XLogP of 0.88, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-4-N-(oxolan-3-yl)pyrimidine-2,4-diamine is sourced from PubChem (CID 91143171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).