2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine

C10H14N2OS — CID 107747529

IUPAC2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine
SMILESCC1OCCC1Sc1ncccc1N
InChIInChI=1S/C10H14N2OS/c1-7-9(4-6-13-7)14-10-8(11)3-2-5-12-10/h2-3,5,7,9H,4,6,11H2,1H3
InChIKeyIPXRJOURQPSENS-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.93
Rot. Bonds2

About 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine

2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine (PubChem CID 107747529) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine.

Molecular Properties

Compound Name2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine
PubChem CID107747529
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine
SMILESCC1OCCC1Sc1ncccc1N
InChIInChI=1S/C10H14N2OS/c1-7-9(4-6-13-7)14-10-8(11)3-2-5-12-10/h2-3,5,7,9H,4,6,11H2,1H3
InChIKeyIPXRJOURQPSENS-UHFFFAOYSA-N
XLogP1.93
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine?
The IUPAC name of 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine (CID 107747529) is 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine.
What is the SMILES notation for 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine?
The canonical SMILES for 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine is CC1OCCC1Sc1ncccc1N.
What is the InChIKey of 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine?
The InChIKey is IPXRJOURQPSENS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-7-9(4-6-13-7)14-10-8(11)3-2-5-12-10/h2-3,5,7,9H,4,6,11H2,1H3.
What are the key properties of 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine?
2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine has a molecular weight of 210.30 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyloxolan-3-yl)sulfanylpyridin-3-amine is sourced from PubChem (CID 107747529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).