3-(2-ethylsulfonylethyl)pyridin-2-amine

C9H14N2O2S — CID 106731715

IUPAC3-(2-ethylsulfonylethyl)pyridin-2-amine
SMILESCCS(=O)(=O)CCc1cccnc1N
InChIInChI=1S/C9H14N2O2S/c1-2-14(12,13)7-5-8-4-3-6-11-9(8)10/h3-4,6H,2,5,7H2,1H3,(H2,10,11)
InChIKeyOTTBGZRYGFPJOI-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.64
Rot. Bonds4

About 3-(2-ethylsulfonylethyl)pyridin-2-amine

3-(2-ethylsulfonylethyl)pyridin-2-amine (PubChem CID 106731715) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is 3-(2-ethylsulfonylethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-(2-ethylsulfonylethyl)pyridin-2-amine
PubChem CID106731715
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC Name3-(2-ethylsulfonylethyl)pyridin-2-amine
SMILESCCS(=O)(=O)CCc1cccnc1N
InChIInChI=1S/C9H14N2O2S/c1-2-14(12,13)7-5-8-4-3-6-11-9(8)10/h3-4,6H,2,5,7H2,1H3,(H2,10,11)
InChIKeyOTTBGZRYGFPJOI-UHFFFAOYSA-N
XLogP0.64
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-ethylsulfonylethyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;3-propylpyridin-2-amine
CID 176926436
3-(methylsulfonylmethyl)pyridin-2-amine
CID 117212620
3-(2-ethylsulfonylethyl)-5-methylpyridin-2-amine
CID 106731740
3-(3-aminopentyl)pyridin-2-amine
CID 64505573
3-(3-bromopentyl)pyridin-2-amine
CID 64508308
1-(2-amino-3-pyridinyl)-4,4-dimethylpentan-3-one
CID 64503842
3-(3,3,3-trifluoropropyl)pyridin-2-amine
CID 163672199
3-[(4R)-4-bromohexyl]pyridin-2-amine
CID 95376898
3-(2-methylpropyl)pyridin-2-amine
CID 20771927
3-(5-methoxypentyl)pyridin-2-amine
CID 104649842
3-[2-(2-methylpropoxy)ethyl]pyridin-2-amine
CID 106458112
(2S)-2-amino-4-(2-amino-3-pyridinyl)butanoic acid
CID 169024941

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylsulfonylethyl)pyridin-2-amine?
The IUPAC name of 3-(2-ethylsulfonylethyl)pyridin-2-amine (CID 106731715) is 3-(2-ethylsulfonylethyl)pyridin-2-amine.
What is the SMILES notation for 3-(2-ethylsulfonylethyl)pyridin-2-amine?
The canonical SMILES for 3-(2-ethylsulfonylethyl)pyridin-2-amine is CCS(=O)(=O)CCc1cccnc1N.
What is the InChIKey of 3-(2-ethylsulfonylethyl)pyridin-2-amine?
The InChIKey is OTTBGZRYGFPJOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-2-14(12,13)7-5-8-4-3-6-11-9(8)10/h3-4,6H,2,5,7H2,1H3,(H2,10,11).
What are the key properties of 3-(2-ethylsulfonylethyl)pyridin-2-amine?
3-(2-ethylsulfonylethyl)pyridin-2-amine has a molecular weight of 214.29 g/mol, XLogP of 0.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylsulfonylethyl)pyridin-2-amine is sourced from PubChem (CID 106731715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).