2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride

C12H23ClN2 — CID 70525718

IUPAC2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride
SMILESCN(C)NC12CC3CC(CC(C3)C1)C2.Cl
InChIInChI=1S/C12H22N2.ClH/c1-14(2)13-12-6-9-3-10(7-12)5-11(4-9)8-12;/h9-11,13H,3-8H2,1-2H3;1H
InChIKeyNNKSHBCDVYHPQT-UHFFFAOYSA-N
MW230.78 g/mol
LogP2.44
Rot. Bonds2

About 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride

2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride (PubChem CID 70525718) has the molecular formula C12H23ClN2 and a molecular weight of 230.78 g/mol. Its IUPAC name is 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride.

Molecular Properties

Compound Name2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride
PubChem CID70525718
Molecular FormulaC12H23ClN2
Molecular Weight230.78 g/mol
Exact Mass230.15
IUPAC Name2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride
SMILESCN(C)NC12CC3CC(CC(C3)C1)C2.Cl
InChIInChI=1S/C12H22N2.ClH/c1-14(2)13-12-6-9-3-10(7-12)5-11(4-9)8-12;/h9-11,13H,3-8H2,1-2H3;1H
InChIKeyNNKSHBCDVYHPQT-UHFFFAOYSA-N
XLogP2.44
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.78
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride?
The IUPAC name of 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride (CID 70525718) is 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride.
What is the SMILES notation for 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride?
The canonical SMILES for 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride is CN(C)NC12CC3CC(CC(C3)C1)C2.Cl.
What is the InChIKey of 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride?
The InChIKey is NNKSHBCDVYHPQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2.ClH/c1-14(2)13-12-6-9-3-10(7-12)5-11(4-9)8-12;/h9-11,13H,3-8H2,1-2H3;1H.
What are the key properties of 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride?
2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride has a molecular weight of 230.78 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-1,1-dimethylhydrazine;hydrochloride is sourced from PubChem (CID 70525718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).