6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine

C13H21N3OS — CID 133378493

IUPAC6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine
SMILESCCOc1cncc(NC2CCCC2SCC)n1
InChIInChI=1S/C13H21N3OS/c1-3-17-13-9-14-8-12(16-13)15-10-6-5-7-11(10)18-4-2/h8-11H,3-7H2,1-2H3,(H,15,16)
InChIKeyQDMLNRXJWKCJFD-UHFFFAOYSA-N
MW267.40 g/mol
LogP2.96
Rot. Bonds6

About 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine

6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine (PubChem CID 133378493) has the molecular formula C13H21N3OS and a molecular weight of 267.40 g/mol. Its IUPAC name is 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine
PubChem CID133378493
Molecular FormulaC13H21N3OS
Molecular Weight267.40 g/mol
Exact Mass267.14
IUPAC Name6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine
SMILESCCOc1cncc(NC2CCCC2SCC)n1
InChIInChI=1S/C13H21N3OS/c1-3-17-13-9-14-8-12(16-13)15-10-6-5-7-11(10)18-4-2/h8-11H,3-7H2,1-2H3,(H,15,16)
InChIKeyQDMLNRXJWKCJFD-UHFFFAOYSA-N
XLogP2.96
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(aminomethyl)cyclohexyl]-6-ethoxypyrazin-2-amine
CID 112753139
N-(2-ethylsulfanylcyclopentyl)-5-methylpyrimidin-2-amine
CID 103858190
4-N-(2-ethylsulfanylcyclopentyl)-2-N,2-N-dimethylpyrimidine-2,4-diamine
CID 103725102
4-N-(2-ethylsulfanylcyclopentyl)pyrimidine-2,4,6-triamine
CID 114122138
2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine
CID 114122162
6-[[(1S,2S)-2-ethylsulfanylcyclopentyl]amino]pyridine-3-carbonitrile
CID 96525974
N-(2-ethylsulfanylcyclopentyl)-5-(trifluoromethyl)pyridin-2-amine
CID 103804882
2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine
CID 102634526
5-chloro-N-(2-ethylsulfanylcyclopentyl)-2-methoxypyrimidin-4-amine
CID 103804863
6-chloro-N-(2-methylsulfanylcyclopentyl)pyrazin-2-amine
CID 103704052
methyl 6-[(2-ethylsulfanylcyclopentyl)amino]-2-methoxypyridine-3-carboxylate
CID 133492487
N-(2-ethylsulfanylcyclopentyl)-4-methylpyrimidin-2-amine
CID 103725083

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine?
The IUPAC name of 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine (CID 133378493) is 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine.
What is the SMILES notation for 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine?
The canonical SMILES for 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine is CCOc1cncc(NC2CCCC2SCC)n1.
What is the InChIKey of 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine?
The InChIKey is QDMLNRXJWKCJFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3OS/c1-3-17-13-9-14-8-12(16-13)15-10-6-5-7-11(10)18-4-2/h8-11H,3-7H2,1-2H3,(H,15,16).
What are the key properties of 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine?
6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine has a molecular weight of 267.40 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine is sourced from PubChem (CID 133378493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).