3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine

C11H18N4 — CID 102985894

IUPAC3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine
SMILESCC1(Nc2nccnc2N)CCCCC1
InChIInChI=1S/C11H18N4/c1-11(5-3-2-4-6-11)15-10-9(12)13-7-8-14-10/h7-8H,2-6H2,1H3,(H2,12,13)(H,14,15)
InChIKeyFBXBFSPKEZOFPY-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.19
Rot. Bonds2

About 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine

3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine (PubChem CID 102985894) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine
PubChem CID102985894
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine
SMILESCC1(Nc2nccnc2N)CCCCC1
InChIInChI=1S/C11H18N4/c1-11(5-3-2-4-6-11)15-10-9(12)13-7-8-14-10/h7-8H,2-6H2,1H3,(H2,12,13)(H,14,15)
InChIKeyFBXBFSPKEZOFPY-UHFFFAOYSA-N
XLogP2.19
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[(3-aminopyrazin-2-yl)amino]cyclohexyl]methanol
CID 102984251
3-N-(1-methylcyclopentyl)pyridine-2,3-diamine
CID 104540031
3-bromo-2-N-(1-methylcyclohexyl)pyridine-2,5-diamine
CID 79534270
5-fluoro-4-N-(1-methylcyclohexyl)pyrimidine-2,4-diamine
CID 80819842
3-N-(2,2-dimethylcyclohexyl)pyrazine-2,3-diamine
CID 103753764
6-chloro-2-N-(1-methylcyclohexyl)pyridine-2,3-diamine
CID 115474028
5-methyl-2-N-(1-methylcyclopentyl)pyridine-2,3-diamine
CID 66280623
[1-[(3-aminopyrazin-2-yl)amino]cyclopropyl]methanol
CID 102987396
2-hydrazinyl-5-methyl-N-(1-methylcyclohexyl)pyrimidin-4-amine
CID 80904000
3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine
CID 106875940
3-N-(3,3-dimethylcyclopentyl)pyrazine-2,3-diamine
CID 103883799
5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine
CID 80915172

Frequently Asked Questions

What is the IUPAC name of 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine?
The IUPAC name of 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine (CID 102985894) is 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine.
What is the SMILES notation for 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine?
The canonical SMILES for 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine is CC1(Nc2nccnc2N)CCCCC1.
What is the InChIKey of 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine?
The InChIKey is FBXBFSPKEZOFPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-11(5-3-2-4-6-11)15-10-9(12)13-7-8-14-10/h7-8H,2-6H2,1H3,(H2,12,13)(H,14,15).
What are the key properties of 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine?
3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine has a molecular weight of 206.29 g/mol, XLogP of 2.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine is sourced from PubChem (CID 102985894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).