2-[2-(sulfinoamino)ethyl]pyridine

C7H10N2O2S — CID 68546056

IUPAC2-[2-(sulfinoamino)ethyl]pyridine
SMILESO=S(O)NCCc1ccccn1
InChIInChI=1S/C7H10N2O2S/c10-12(11)9-6-4-7-3-1-2-5-8-7/h1-3,5,9H,4,6H2,(H,10,11)
InChIKeySVIPKIRVEQHLKU-UHFFFAOYSA-N
MW186.24 g/mol
LogP0.35
Rot. Bonds4

About 2-[2-(sulfinoamino)ethyl]pyridine

2-[2-(sulfinoamino)ethyl]pyridine (PubChem CID 68546056) has the molecular formula C7H10N2O2S and a molecular weight of 186.24 g/mol. Its IUPAC name is 2-[2-(sulfinoamino)ethyl]pyridine.

Molecular Properties

Compound Name2-[2-(sulfinoamino)ethyl]pyridine
PubChem CID68546056
Molecular FormulaC7H10N2O2S
Molecular Weight186.24 g/mol
Exact Mass186.05
IUPAC Name2-[2-(sulfinoamino)ethyl]pyridine
SMILESO=S(O)NCCc1ccccn1
InChIInChI=1S/C7H10N2O2S/c10-12(11)9-6-4-7-3-1-2-5-8-7/h1-3,5,9H,4,6H2,(H,10,11)
InChIKeySVIPKIRVEQHLKU-UHFFFAOYSA-N
XLogP0.35
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.24
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

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Related Compounds

2-pyridin-2-ylethyl hydrogen sulfite
CID 57284965
2-pyridin-2-ylethylcarbamothioic S-acid
CID 87074091
N-methyl-2-pyridin-2-ylethanamine dichloride
CID 45114105
1-(3-hydroxypropyl)-3-(2-pyridin-2-ylethyl)urea
CID 110892181
N-methyl-2-pyridin-2-ylethanamine;hydroiodide
CID 135260552
2-ethylpyridine;sulfurous acid
CID 174743952
2-pyridin-2-yl-N-[2-[2-(2-pyridin-2-ylethylamino)ethyldisulfanyl]ethyl]ethanamine
CID 101109360
ethane;2-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 142112887
3-(2-pyridin-2-ylethylamino)propanoic acid
CID 28830364
2-[2-[(S)-methylsulfinyl]ethyl]pyridine
CID 97301952
4-pyridin-2-yl-N-(3-pyridin-2-ylpropyl)butanamide
CID 166230056
3-(2-hydroxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide
CID 47141809

Frequently Asked Questions

What is the IUPAC name of 2-[2-(sulfinoamino)ethyl]pyridine?
The IUPAC name of 2-[2-(sulfinoamino)ethyl]pyridine (CID 68546056) is 2-[2-(sulfinoamino)ethyl]pyridine.
What is the SMILES notation for 2-[2-(sulfinoamino)ethyl]pyridine?
The canonical SMILES for 2-[2-(sulfinoamino)ethyl]pyridine is O=S(O)NCCc1ccccn1.
What is the InChIKey of 2-[2-(sulfinoamino)ethyl]pyridine?
The InChIKey is SVIPKIRVEQHLKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2S/c10-12(11)9-6-4-7-3-1-2-5-8-7/h1-3,5,9H,4,6H2,(H,10,11).
What are the key properties of 2-[2-(sulfinoamino)ethyl]pyridine?
2-[2-(sulfinoamino)ethyl]pyridine has a molecular weight of 186.24 g/mol, XLogP of 0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(sulfinoamino)ethyl]pyridine is sourced from PubChem (CID 68546056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).