N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine

C12H21N5 — CID 80912256

IUPACN-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine
SMILESCC1CCC(Nc2cncc(NN)n2)C(C)C1
InChIInChI=1S/C12H21N5/c1-8-3-4-10(9(2)5-8)15-11-6-14-7-12(16-11)17-13/h6-10H,3-5,13H2,1-2H3,(H2,15,16,17)
InChIKeyGBPTVZSBWZDTKO-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.00
Rot. Bonds3

About N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine

N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine (PubChem CID 80912256) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine.

Molecular Properties

Compound NameN-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine
PubChem CID80912256
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC NameN-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine
SMILESCC1CCC(Nc2cncc(NN)n2)C(C)C1
InChIInChI=1S/C12H21N5/c1-8-3-4-10(9(2)5-8)15-11-6-14-7-12(16-11)17-13/h6-10H,3-5,13H2,1-2H3,(H2,15,16,17)
InChIKeyGBPTVZSBWZDTKO-UHFFFAOYSA-N
XLogP2.00
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine?
The IUPAC name of N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine (CID 80912256) is N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine.
What is the SMILES notation for N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine?
The canonical SMILES for N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine is CC1CCC(Nc2cncc(NN)n2)C(C)C1.
What is the InChIKey of N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine?
The InChIKey is GBPTVZSBWZDTKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-8-3-4-10(9(2)5-8)15-11-6-14-7-12(16-11)17-13/h6-10H,3-5,13H2,1-2H3,(H2,15,16,17).
What are the key properties of N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine?
N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 2.00, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyrazin-2-amine is sourced from PubChem (CID 80912256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).