2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide

C9H19N3O — CID 83021936

IUPAC2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide
SMILESCN(C)NC(=O)C1CCCCC1N
InChIInChI=1S/C9H19N3O/c1-12(2)11-9(13)7-5-3-4-6-8(7)10/h7-8H,3-6,10H2,1-2H3,(H,11,13)
InChIKeyJYAXKHQXHXNCEA-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.10
Rot. Bonds2

About 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide

2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide (PubChem CID 83021936) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide.

Molecular Properties

Compound Name2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide
PubChem CID83021936
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide
SMILESCN(C)NC(=O)C1CCCCC1N
InChIInChI=1S/C9H19N3O/c1-12(2)11-9(13)7-5-3-4-6-8(7)10/h7-8H,3-6,10H2,1-2H3,(H,11,13)
InChIKeyJYAXKHQXHXNCEA-UHFFFAOYSA-N
XLogP0.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide?
The IUPAC name of 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide (CID 83021936) is 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide.
What is the SMILES notation for 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide?
The canonical SMILES for 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide is CN(C)NC(=O)C1CCCCC1N.
What is the InChIKey of 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide?
The InChIKey is JYAXKHQXHXNCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-12(2)11-9(13)7-5-3-4-6-8(7)10/h7-8H,3-6,10H2,1-2H3,(H,11,13).
What are the key properties of 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide?
2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide has a molecular weight of 185.27 g/mol, XLogP of 0.10, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide is sourced from PubChem (CID 83021936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).