2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine

C11H15N3S — CID 116505051

IUPAC2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine
SMILESCCSCCc1nc2ccccn2c1N
InChIInChI=1S/C11H15N3S/c1-2-15-8-6-9-11(12)14-7-4-3-5-10(14)13-9/h3-5,7H,2,6,8,12H2,1H3
InChIKeySRRQFUAMKOWUDP-UHFFFAOYSA-N
MW221.33 g/mol
LogP2.21
Rot. Bonds4

About 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine

2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 116505051) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID116505051
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC Name2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine
SMILESCCSCCc1nc2ccccn2c1N
InChIInChI=1S/C11H15N3S/c1-2-15-8-6-9-11(12)14-7-4-3-5-10(14)13-9/h3-5,7H,2,6,8,12H2,1H3
InChIKeySRRQFUAMKOWUDP-UHFFFAOYSA-N
XLogP2.21
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-ethylimidazo[1,2-a]pyridin-3-amine
CID 63617913
6-chloro-2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine
CID 116505054
2-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-3-amine
CID 63619289
4-(2-ethylsulfanylethyl)quinazolin-2-amine
CID 154004824
sodium (4R,5S,6S)-3-[2-(3-aminoimidazo[1,2-a]pyridin-2-yl)ethylsulfanyl]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
CID 139746858
(4-nitrophenyl)methyl (4R,5S,6S)-3-[2-(3-aminoimidazo[1,2-a]pyridin-2-yl)ethylsulfanyl]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
CID 56980994
N-(3-aminoimidazo[1,2-a]pyridin-2-yl)acetamide
CID 83773502
1-(2-ethylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 76849304
N-methyl-1-(2-methylsulfanylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 63814200
6-fluoro-2-propylimidazo[1,2-a]pyridin-3-amine
CID 63619000
2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine;hydrochloride
CID 154583974
2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine;hydrochloride
CID 138039813

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine (CID 116505051) is 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine is CCSCCc1nc2ccccn2c1N.
What is the InChIKey of 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is SRRQFUAMKOWUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-2-15-8-6-9-11(12)14-7-4-3-5-10(14)13-9/h3-5,7H,2,6,8,12H2,1H3.
What are the key properties of 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine?
2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 221.33 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylsulfanylethyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 116505051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).