2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine

C14H23N3S — CID 114122162

IUPAC2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine
SMILESCCNc1cccc(NC2CCCC2SCC)n1
InChIInChI=1S/C14H23N3S/c1-3-15-13-9-6-10-14(17-13)16-11-7-5-8-12(11)18-4-2/h6,9-12H,3-5,7-8H2,1-2H3,(H2,15,16,17)
InChIKeyYCMFXMJNPWINFY-UHFFFAOYSA-N
MW265.43 g/mol
LogP3.60
Rot. Bonds6

About 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine

2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine (PubChem CID 114122162) has the molecular formula C14H23N3S and a molecular weight of 265.43 g/mol. Its IUPAC name is 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine
PubChem CID114122162
Molecular FormulaC14H23N3S
Molecular Weight265.43 g/mol
Exact Mass265.16
IUPAC Name2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine
SMILESCCNc1cccc(NC2CCCC2SCC)n1
InChIInChI=1S/C14H23N3S/c1-3-15-13-9-6-10-14(17-13)16-11-7-5-8-12(11)18-4-2/h6,9-12H,3-5,7-8H2,1-2H3,(H2,15,16,17)
InChIKeyYCMFXMJNPWINFY-UHFFFAOYSA-N
XLogP3.60
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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
methyl 6-[(2-ethylsulfanylcyclopentyl)amino]-2-methoxypyridine-3-carboxylate
CID 133492487
2-N-ethyl-6-N-(3-ethyl-2-methylcyclopentyl)pyridine-2,6-diamine
CID 80840678
2-N-ethyl-6-N-(3-methylcyclohexyl)pyridine-2,6-diamine
CID 80782760
3-N-(2-ethylsulfanylcyclopentyl)-2-methylbenzene-1,3-diamine
CID 114121308
N-(2-ethylsulfanylcyclopentyl)-4-methylpyrimidin-2-amine
CID 103725083
6-[[(1S,2S)-2-ethylsulfanylcyclopentyl]amino]pyridine-3-carbonitrile
CID 96525974
N-(2-ethylsulfanylcyclopentyl)-5-(trifluoromethyl)pyridin-2-amine
CID 103804882
6-ethoxy-N-(2-ethylsulfanylcyclopentyl)pyrazin-2-amine
CID 133378493
N-(2-ethylsulfanylcyclopentyl)-6-nitroquinolin-2-amine
CID 133378444
6-ethyl-N-(2-ethylsulfanylcyclopentyl)-2-pyridin-4-ylpyrimidin-4-amine
CID 133357230

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine?
The IUPAC name of 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine (CID 114122162) is 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine.
What is the SMILES notation for 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine?
The canonical SMILES for 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine is CCNc1cccc(NC2CCCC2SCC)n1.
What is the InChIKey of 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine?
The InChIKey is YCMFXMJNPWINFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3S/c1-3-15-13-9-6-10-14(17-13)16-11-7-5-8-12(11)18-4-2/h6,9-12H,3-5,7-8H2,1-2H3,(H2,15,16,17).
What are the key properties of 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine?
2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine has a molecular weight of 265.43 g/mol, XLogP of 3.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-6-N-(2-ethylsulfanylcyclopentyl)pyridine-2,6-diamine is sourced from PubChem (CID 114122162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).