3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine

C12H20N4 — CID 103753764

IUPAC3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine
SMILESCC1(C)CCCCC1Nc1nccnc1N
InChIInChI=1S/C12H20N4/c1-12(2)6-4-3-5-9(12)16-11-10(13)14-7-8-15-11/h7-9H,3-6H2,1-2H3,(H2,13,14)(H,15,16)
InChIKeyFKBJSLACIWCYNN-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.44
Rot. Bonds2

About 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine

3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine (PubChem CID 103753764) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine
PubChem CID103753764
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine
SMILESCC1(C)CCCCC1Nc1nccnc1N
InChIInChI=1S/C12H20N4/c1-12(2)6-4-3-5-9(12)16-11-10(13)14-7-8-15-11/h7-9H,3-6H2,1-2H3,(H2,13,14)(H,15,16)
InChIKeyFKBJSLACIWCYNN-UHFFFAOYSA-N
XLogP2.44
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-(2,2-dimethylcyclohexyl)pyridine-2,3-diamine
CID 104540565
N-(2,2-dimethylcyclopentyl)-3-methylpyrazin-2-amine
CID 83064774
6-chloro-4-N-(2,2-dimethylcyclohexyl)pyrimidine-4,5-diamine
CID 79862142
4-N-(2,2-dimethylcyclohexyl)-5-fluoropyrimidine-2,4-diamine
CID 80849472
2-[(2,2-dimethylcyclohexyl)amino]pyridine-3-carbothioamide
CID 79877924
N-(2,2-dimethylcyclohexyl)-3-methylsulfonylpyridin-2-amine
CID 114598974
3-amino-2-[(2,2-dimethylcyclopentyl)amino]pyridine-4-carbonitrile
CID 82812965
3-N-(3,3-dimethylcyclopentyl)pyrazine-2,3-diamine
CID 103883799
4-N-(2,2-dimethylcyclohexyl)pyrimidine-4,6-diamine
CID 80849471
N-(2,2-dimethylcyclohexyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80929258
5-bromo-4-N-(2,2-dimethylcyclohexyl)-2-N-methylpyrimidine-2,4-diamine
CID 80849952
N-(2,2-dimethylcyclohexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731858

Frequently Asked Questions

What is the IUPAC name of 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine?
The IUPAC name of 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine (CID 103753764) is 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine.
What is the SMILES notation for 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine?
The canonical SMILES for 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine is CC1(C)CCCCC1Nc1nccnc1N.
What is the InChIKey of 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine?
The InChIKey is FKBJSLACIWCYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-12(2)6-4-3-5-9(12)16-11-10(13)14-7-8-15-11/h7-9H,3-6H2,1-2H3,(H2,13,14)(H,15,16).
What are the key properties of 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine?
3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine has a molecular weight of 220.32 g/mol, XLogP of 2.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine is sourced from PubChem (CID 103753764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).