3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine

C16H22N4 — CID 102986061

IUPAC3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine
SMILESCC1CCCCC1N(C)c1nc2ccccc2nc1N
InChIInChI=1S/C16H22N4/c1-11-7-3-6-10-14(11)20(2)16-15(17)18-12-8-4-5-9-13(12)19-16/h4-5,8-9,11,14H,3,6-7,10H2,1-2H3,(H2,17,18)
InChIKeyITMALBVOURPNNU-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.23
Rot. Bonds2

About 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine

3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine (PubChem CID 102986061) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine.

Molecular Properties

Compound Name3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine
PubChem CID102986061
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine
SMILESCC1CCCCC1N(C)c1nc2ccccc2nc1N
InChIInChI=1S/C16H22N4/c1-11-7-3-6-10-14(11)20(2)16-15(17)18-12-8-4-5-9-13(12)19-16/h4-5,8-9,11,14H,3,6-7,10H2,1-2H3,(H2,17,18)
InChIKeyITMALBVOURPNNU-UHFFFAOYSA-N
XLogP3.23
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-cycloheptyl-3-N-methylquinoxaline-2,3-diamine
CID 102985570
3-N-cyclobutyl-3-N-methylquinoxaline-2,3-diamine
CID 102987398
2-N,6-dimethyl-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine
CID 81131626
2-N-methyl-2-N-(2-methylcyclohexyl)-3-nitropyridine-2,6-diamine
CID 80820849
1-(2-methylcyclohexyl)-1-phenylhydrazine
CID 19593890
3-bromo-2-N-methyl-2-N-(2-methylcyclohexyl)pyridine-2,5-diamine
CID 79535351
3-chloro-2-N-methyl-2-N-(2-methylcyclohexyl)pyridine-2,5-diamine
CID 114046172
6-hydrazinyl-N-methyl-N-(2-methylcyclohexyl)pyridin-2-amine
CID 80900450
2-[(1R)-1-aminoethyl]-N-methyl-N-(2-methylcyclohexyl)aniline
CID 78935534
4-(1-aminoethyl)-N-methyl-N-(2-methylcyclohexyl)aniline
CID 55004836
3-N-methyl-3-N-(2-methylcyclohexyl)-1H-1,2,4-triazole-3,5-diamine
CID 66274935
3-N-methyl-3-N-propylquinoxaline-2,3-diamine
CID 102985418

Frequently Asked Questions

What is the IUPAC name of 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine?
The IUPAC name of 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine (CID 102986061) is 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine.
What is the SMILES notation for 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine?
The canonical SMILES for 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine is CC1CCCCC1N(C)c1nc2ccccc2nc1N.
What is the InChIKey of 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine?
The InChIKey is ITMALBVOURPNNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-11-7-3-6-10-14(11)20(2)16-15(17)18-12-8-4-5-9-13(12)19-16/h4-5,8-9,11,14H,3,6-7,10H2,1-2H3,(H2,17,18).
What are the key properties of 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine?
3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine has a molecular weight of 270.38 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-methyl-3-N-(2-methylcyclohexyl)quinoxaline-2,3-diamine is sourced from PubChem (CID 102986061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).