2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine

C11H17N3O2 — CID 82457771

IUPAC2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine
SMILESCCCOc1cc(N)nc(C2CCCO2)n1
InChIInChI=1S/C11H17N3O2/c1-2-5-16-10-7-9(12)13-11(14-10)8-4-3-6-15-8/h7-8H,2-6H2,1H3,(H2,12,13,14)
InChIKeyGTZLHLIQKXYSTQ-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.70
Rot. Bonds4

About 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine

2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine (PubChem CID 82457771) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine.

Molecular Properties

Compound Name2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine
PubChem CID82457771
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine
SMILESCCCOc1cc(N)nc(C2CCCO2)n1
InChIInChI=1S/C11H17N3O2/c1-2-5-16-10-7-9(12)13-11(14-10)8-4-3-6-15-8/h7-8H,2-6H2,1H3,(H2,12,13,14)
InChIKeyGTZLHLIQKXYSTQ-UHFFFAOYSA-N
XLogP1.70
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-butoxy-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82457803
6-(2-methylpropoxy)-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82457787
2-cyclopropyl-6-propoxypyrimidin-4-amine
CID 80965669
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)-6-propoxypyrimidin-4-amine
CID 82457766
N-(2-methylpropyl)-2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine
CID 82457767
N-cyclopropyl-6-ethoxy-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82457723
4-N-(2-methylpropyl)-2-(oxolan-2-yl)-6-propoxypyrimidine-4,5-diamine
CID 82457921
6-butoxy-2-(oxolan-2-yl)-4-N-propan-2-ylpyrimidine-4,5-diamine
CID 82457938
6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine
CID 80950568
6-(2-methylpropoxy)-2-(oxolan-2-yl)-N-pentylpyrimidin-4-amine
CID 82457782
2-cyclopropyl-6-(4-propoxyphenoxy)pyrimidin-4-amine
CID 80966516
N-(3-ethoxypropyl)-6-methoxy-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82457692

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine?
The IUPAC name of 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine (CID 82457771) is 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine.
What is the SMILES notation for 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine?
The canonical SMILES for 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine is CCCOc1cc(N)nc(C2CCCO2)n1.
What is the InChIKey of 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine?
The InChIKey is GTZLHLIQKXYSTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-2-5-16-10-7-9(12)13-11(14-10)8-4-3-6-15-8/h7-8H,2-6H2,1H3,(H2,12,13,14).
What are the key properties of 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine?
2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine has a molecular weight of 223.28 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine is sourced from PubChem (CID 82457771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).