5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine

C11H17N3OS — CID 107765165

IUPAC5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine
SMILESCCc1c(N)ncnc1SC1CCOC1C
InChIInChI=1S/C11H17N3OS/c1-3-8-10(12)13-6-14-11(8)16-9-4-5-15-7(9)2/h6-7,9H,3-5H2,1-2H3,(H2,12,13,14)
InChIKeySPWOYFZQUXWVFI-UHFFFAOYSA-N
MW239.34 g/mol
LogP1.89
Rot. Bonds3

About 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine

5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine (PubChem CID 107765165) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine
PubChem CID107765165
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine
SMILESCCc1c(N)ncnc1SC1CCOC1C
InChIInChI=1S/C11H17N3OS/c1-3-8-10(12)13-6-14-11(8)16-9-4-5-15-7(9)2/h6-7,9H,3-5H2,1-2H3,(H2,12,13,14)
InChIKeySPWOYFZQUXWVFI-UHFFFAOYSA-N
XLogP1.89
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-ethyl-N-methyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine
CID 107765189
5-ethyl-6-(2-methyloxolan-3-yl)sulfanyl-N-propylpyrimidin-4-amine
CID 107765164
5-ethyl-6-ethylsulfanylpyrimidin-4-amine
CID 80887544
2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine
CID 107747529
[6-(2-methyloxolan-3-yl)sulfanyl-5-nitropyrimidin-4-yl]hydrazine
CID 107766184
[6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-yl]hydrazine
CID 107766154
(1R)-1-[5-(2-methyloxolan-3-yl)sulfanyl-2-pyridinyl]propan-1-amine
CID 107750568
[4,6-dimethyl-2-(2-methyloxolan-3-yl)sulfanyl-3-pyridinyl]methanamine
CID 107751923
4-chloro-2-ethyl-5-methyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidine
CID 107751016
[2-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-yl]methanamine
CID 107751932
6-(2-methyloxolan-3-yl)sulfanyl-2-propylpyrimidin-4-amine
CID 107765101
2-(6-amino-5-ethylpyrimidin-4-yl)sulfanylpyrimidine-4,6-diamine
CID 80885324

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine (CID 107765165) is 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine is CCc1c(N)ncnc1SC1CCOC1C.
What is the InChIKey of 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine?
The InChIKey is SPWOYFZQUXWVFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-3-8-10(12)13-6-14-11(8)16-9-4-5-15-7(9)2/h6-7,9H,3-5H2,1-2H3,(H2,12,13,14).
What are the key properties of 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine?
5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine has a molecular weight of 239.34 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-(2-methyloxolan-3-yl)sulfanylpyrimidin-4-amine is sourced from PubChem (CID 107765165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).