3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine

C15H19N3S — CID 103704143

IUPAC3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine
SMILESCSC1CCC(Nc2nc3ccccc3nc2C)C1
InChIInChI=1S/C15H19N3S/c1-10-15(17-11-7-8-12(9-11)19-2)18-14-6-4-3-5-13(14)16-10/h3-6,11-12H,7-9H2,1-2H3,(H,17,18)
InChIKeyYNXJTBGGSSBDGE-UHFFFAOYSA-N
MW273.40 g/mol
LogP3.63
Rot. Bonds3

About 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine

3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine (PubChem CID 103704143) has the molecular formula C15H19N3S and a molecular weight of 273.40 g/mol. Its IUPAC name is 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine.

Molecular Properties

Compound Name3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine
PubChem CID103704143
Molecular FormulaC15H19N3S
Molecular Weight273.40 g/mol
Exact Mass273.13
IUPAC Name3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine
SMILESCSC1CCC(Nc2nc3ccccc3nc2C)C1
InChIInChI=1S/C15H19N3S/c1-10-15(17-11-7-8-12(9-11)19-2)18-14-6-4-3-5-13(14)16-10/h3-6,11-12H,7-9H2,1-2H3,(H,17,18)
InChIKeyYNXJTBGGSSBDGE-UHFFFAOYSA-N
XLogP3.63
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(3-methylsulfanylcyclopentyl)phthalazin-1-amine
CID 103704104
N-(3,5-dimethylcyclohexyl)-3-methylquinoxalin-2-amine
CID 64731715
N-(4-ethylcyclohexyl)-3-methylquinoxalin-2-amine
CID 63539648
3-methyl-N-(4-propylcyclohexyl)quinoxalin-2-amine
CID 63541823
3-methyl-N-(thian-3-yl)quinoxalin-2-amine
CID 115675173
5,6-dimethyl-3-[(3-methylsulfanylcyclopentyl)amino]pyridazine-4-carbonitrile
CID 113244155
3-methyl-N-(2-methylcyclohexyl)quinoxalin-2-amine
CID 60730168
4-[(3-methylsulfanylcyclopentyl)amino]cinnoline-3-carbonitrile
CID 103704215
N-(3-methylsulfanylcyclopentyl)thieno[3,2-d]pyrimidin-4-amine
CID 113244147
N-(3-methylsulfanylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
CID 103704155
3,5-dichloro-6-N-(3-methylsulfanylcyclopentyl)pyridine-2,6-diamine
CID 114124115
3-chloro-5,6-dimethyl-N-(3-methylsulfanylcyclohexyl)pyrazin-2-amine
CID 114123728

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine?
The IUPAC name of 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine (CID 103704143) is 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine.
What is the SMILES notation for 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine?
The canonical SMILES for 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine is CSC1CCC(Nc2nc3ccccc3nc2C)C1.
What is the InChIKey of 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine?
The InChIKey is YNXJTBGGSSBDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3S/c1-10-15(17-11-7-8-12(9-11)19-2)18-14-6-4-3-5-13(14)16-10/h3-6,11-12H,7-9H2,1-2H3,(H,17,18).
What are the key properties of 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine?
3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine has a molecular weight of 273.40 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-methylsulfanylcyclopentyl)quinoxalin-2-amine is sourced from PubChem (CID 103704143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).