6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine

C12H19N3O2 — CID 80950568

IUPAC6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)cc(OCC2CCCO2)n1
InChIInChI=1S/C12H19N3O2/c1-2-4-11-14-10(13)7-12(15-11)17-8-9-5-3-6-16-9/h7,9H,2-6,8H2,1H3,(H2,13,14,15)
InChIKeyPBWYBEYDEYTCEC-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.57
Rot. Bonds5

About 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine

6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine (PubChem CID 80950568) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine
PubChem CID80950568
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)cc(OCC2CCCO2)n1
InChIInChI=1S/C12H19N3O2/c1-2-4-11-14-10(13)7-12(15-11)17-8-9-5-3-6-16-9/h7,9H,2-6,8H2,1H3,(H2,13,14,15)
InChIKeyPBWYBEYDEYTCEC-UHFFFAOYSA-N
XLogP1.57
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(oxan-2-ylmethoxy)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106773775
4-N-methyl-6-(oxolan-2-ylmethoxy)pyrimidine-2,4-diamine
CID 80859711
4-chloro-2-methylsulfanyl-6-(oxolan-2-ylmethoxy)pyrimidine
CID 80544680
2-(oxolan-2-yl)-6-propoxypyrimidin-4-amine
CID 82457771
6-(oxolan-2-ylmethoxy)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80966071
6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine
CID 103408442
6-butoxy-2-(oxolan-2-yl)pyrimidin-4-amine
CID 82457803
N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine
CID 80860142
6-(oxan-2-ylmethoxy)pyridine-2,3-diamine
CID 79827597
N-methyl-6-(oxolan-2-ylmethoxy)-2-propan-2-ylpyrimidin-4-amine
CID 80965962
2-propyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80949557
2-chloro-6-(oxolan-2-ylmethoxy)-4-(trichloromethyl)pyridine
CID 21330006

Frequently Asked Questions

What is the IUPAC name of 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine?
The IUPAC name of 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine (CID 80950568) is 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine is CCCc1nc(N)cc(OCC2CCCO2)n1.
What is the InChIKey of 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine?
The InChIKey is PBWYBEYDEYTCEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-2-4-11-14-10(13)7-12(15-11)17-8-9-5-3-6-16-9/h7,9H,2-6,8H2,1H3,(H2,13,14,15).
What are the key properties of 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine?
6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine has a molecular weight of 237.30 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(oxolan-2-ylmethoxy)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 80950568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).