4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol

C13H21N3O — CID 106130416

IUPAC4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol
SMILESCc1ncc(NCC2CCC(O)CC2)nc1C
InChIInChI=1S/C13H21N3O/c1-9-10(2)16-13(8-14-9)15-7-11-3-5-12(17)6-4-11/h8,11-12,17H,3-7H2,1-2H3,(H,15,16)
InChIKeyVARWYOXALPNBKB-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.06
Rot. Bonds3

About 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol

4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 106130416) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol
PubChem CID106130416
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol
SMILESCc1ncc(NCC2CCC(O)CC2)nc1C
InChIInChI=1S/C13H21N3O/c1-9-10(2)16-13(8-14-9)15-7-11-3-5-12(17)6-4-11/h8,11-12,17H,3-7H2,1-2H3,(H,15,16)
InChIKeyVARWYOXALPNBKB-UHFFFAOYSA-N
XLogP2.06
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

N-[(4-chlorocyclohexyl)methyl]-5,6-dimethylpyrazin-2-amine
CID 106126001
5,6-dimethyl-N-[(3-methylcyclopentyl)methyl]pyrazin-2-amine
CID 107414033
5,6-dimethyl-N-(oxan-3-ylmethyl)pyrazin-2-amine
CID 114475438
N-[(1,1-dioxothiolan-3-yl)methyl]-5,6-dimethylpyrazin-2-amine
CID 114475447
4-[[(6-aminopyrazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 106137920
4-[[(6-hydrazinylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 106138813
4-[[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106138816
N-(2-cyclohexylethyl)-5,6-dimethylpyrazin-2-amine
CID 114475372
2-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclopentane-1-carboxylic acid
CID 114474524
4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106130133
4-[[(5-methyl-4-nitro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 106130818
4-[[(3-methylquinoxalin-2-yl)amino]methyl]cyclohexan-1-ol
CID 106130104

Frequently Asked Questions

What is the IUPAC name of 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol (CID 106130416) is 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol is Cc1ncc(NCC2CCC(O)CC2)nc1C.
What is the InChIKey of 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is VARWYOXALPNBKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-9-10(2)16-13(8-14-9)15-7-11-3-5-12(17)6-4-11/h8,11-12,17H,3-7H2,1-2H3,(H,15,16).
What are the key properties of 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol?
4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol has a molecular weight of 235.33 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(5,6-dimethylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 106130416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).