2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine

C10H18N4O — CID 82455747

IUPAC2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
SMILESCCc1nc(N)c(N)c(OCC(C)C)n1
InChIInChI=1S/C10H18N4O/c1-4-7-13-9(12)8(11)10(14-7)15-5-6(2)3/h6H,4-5,11H2,1-3H3,(H2,12,13,14)
InChIKeySASYZGUSPRBZLG-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.24
Rot. Bonds4

About 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine

2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine (PubChem CID 82455747) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine.

Molecular Properties

Compound Name2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
PubChem CID82455747
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
SMILESCCc1nc(N)c(N)c(OCC(C)C)n1
InChIInChI=1S/C10H18N4O/c1-4-7-13-9(12)8(11)10(14-7)15-5-6(2)3/h6H,4-5,11H2,1-3H3,(H2,12,13,14)
InChIKeySASYZGUSPRBZLG-UHFFFAOYSA-N
XLogP1.24
TPSA87.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine?
The IUPAC name of 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine (CID 82455747) is 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine.
What is the SMILES notation for 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine?
The canonical SMILES for 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine is CCc1nc(N)c(N)c(OCC(C)C)n1.
What is the InChIKey of 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine?
The InChIKey is SASYZGUSPRBZLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-7-13-9(12)8(11)10(14-7)15-5-6(2)3/h6H,4-5,11H2,1-3H3,(H2,12,13,14).
What are the key properties of 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine?
2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine has a molecular weight of 210.28 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine is sourced from PubChem (CID 82455747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).