2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine

C12H20N4O — CID 78988775

IUPAC2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine
SMILESNc1cncc(NCCOC2CCCCC2)n1
InChIInChI=1S/C12H20N4O/c13-11-8-14-9-12(16-11)15-6-7-17-10-4-2-1-3-5-10/h8-10H,1-7H2,(H3,13,15,16)
InChIKeyQCJFENOZUMDTTN-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.82
Rot. Bonds5

About 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine

2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine (PubChem CID 78988775) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine
PubChem CID78988775
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine
SMILESNc1cncc(NCCOC2CCCCC2)n1
InChIInChI=1S/C12H20N4O/c13-11-8-14-9-12(16-11)15-6-7-17-10-4-2-1-3-5-10/h8-10H,1-7H2,(H3,13,15,16)
InChIKeyQCJFENOZUMDTTN-UHFFFAOYSA-N
XLogP1.82
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-N-(2-cyclopentyloxyethyl)pyrazine-2,6-diamine
CID 78988738
2-N-(2-cyclohexyloxyethyl)-6-N-propylpyrazine-2,6-diamine
CID 80846576
6-N-(2-cyclopentyloxyethyl)pyridine-2,6-diamine
CID 80647858
N-(2-cyclohexyloxyethyl)pyrazin-2-amine
CID 61064390
2-N-cyclooctylpyrazine-2,6-diamine
CID 78988887
4-N-(2-cyclohexyloxyethyl)pyrimidine-4,5-diamine
CID 79917375
2-N-(2-cyclopentyloxyethyl)-6-methoxypyridine-2,5-diamine
CID 63826021
2-N-(oxan-4-ylmethyl)pyrazine-2,6-diamine
CID 78989247
4-[[(6-aminopyrazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 106137920
6-bromo-2-N-(2-cyclopentyloxyethyl)pyrimidine-2,4-diamine
CID 116795940
6-N-(2-cyclopentyloxyethyl)-2-N-ethylpyridine-2,6-diamine
CID 80846644
2-N-(2-cyclopentyloxyethyl)-1,3-thiazole-2,5-diamine
CID 102768489

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine?
The IUPAC name of 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine (CID 78988775) is 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine.
What is the SMILES notation for 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine?
The canonical SMILES for 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine is Nc1cncc(NCCOC2CCCCC2)n1.
What is the InChIKey of 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine?
The InChIKey is QCJFENOZUMDTTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c13-11-8-14-9-12(16-11)15-6-7-17-10-4-2-1-3-5-10/h8-10H,1-7H2,(H3,13,15,16).
What are the key properties of 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine?
2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine has a molecular weight of 236.32 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-cyclohexyloxyethyl)pyrazine-2,6-diamine is sourced from PubChem (CID 78988775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).