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

C10H16N4O2 — CID 82737280

IUPAC5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine
SMILESCOc1c(N)ncnc1NC1CCOC1C
InChIInChI=1S/C10H16N4O2/c1-6-7(3-4-16-6)14-10-8(15-2)9(11)12-5-13-10/h5-7H,3-4H2,1-2H3,(H3,11,12,13,14)
InChIKeySTGUWWNTUSRIKX-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.66
Rot. Bonds3

About 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine

5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine (PubChem CID 82737280) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine
PubChem CID82737280
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine
SMILESCOc1c(N)ncnc1NC1CCOC1C
InChIInChI=1S/C10H16N4O2/c1-6-7(3-4-16-6)14-10-8(15-2)9(11)12-5-13-10/h5-7H,3-4H2,1-2H3,(H3,11,12,13,14)
InChIKeySTGUWWNTUSRIKX-UHFFFAOYSA-N
XLogP0.66
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine?
The IUPAC name of 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine (CID 82737280) is 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine.
What is the SMILES notation for 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine?
The canonical SMILES for 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine is COc1c(N)ncnc1NC1CCOC1C.
What is the InChIKey of 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine?
The InChIKey is STGUWWNTUSRIKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-6-7(3-4-16-6)14-10-8(15-2)9(11)12-5-13-10/h5-7H,3-4H2,1-2H3,(H3,11,12,13,14).
What are the key properties of 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine?
5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine has a molecular weight of 224.26 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-N-(2-methyloxolan-3-yl)pyrimidine-4,6-diamine is sourced from PubChem (CID 82737280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).