N',N',2-trimethylpiperidine-2-carbohydrazide

C9H19N3O — CID 104597181

IUPACN',N',2-trimethylpiperidine-2-carbohydrazide
SMILESCN(C)NC(=O)C1(C)CCCCN1
InChIInChI=1S/C9H19N3O/c1-9(6-4-5-7-10-9)8(13)11-12(2)3/h10H,4-7H2,1-3H3,(H,11,13)
InChIKeyJJCYSJWRKMIJPG-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.11
Rot. Bonds2

About N',N',2-trimethylpiperidine-2-carbohydrazide

N',N',2-trimethylpiperidine-2-carbohydrazide (PubChem CID 104597181) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is N',N',2-trimethylpiperidine-2-carbohydrazide.

Molecular Properties

Compound NameN',N',2-trimethylpiperidine-2-carbohydrazide
PubChem CID104597181
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC NameN',N',2-trimethylpiperidine-2-carbohydrazide
SMILESCN(C)NC(=O)C1(C)CCCCN1
InChIInChI=1S/C9H19N3O/c1-9(6-4-5-7-10-9)8(13)11-12(2)3/h10H,4-7H2,1-3H3,(H,11,13)
InChIKeyJJCYSJWRKMIJPG-UHFFFAOYSA-N
XLogP0.11
TPSA44.37 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 ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 N',N',2-trimethylpiperidine-2-carbohydrazide?
The IUPAC name of N',N',2-trimethylpiperidine-2-carbohydrazide (CID 104597181) is N',N',2-trimethylpiperidine-2-carbohydrazide.
What is the SMILES notation for N',N',2-trimethylpiperidine-2-carbohydrazide?
The canonical SMILES for N',N',2-trimethylpiperidine-2-carbohydrazide is CN(C)NC(=O)C1(C)CCCCN1.
What is the InChIKey of N',N',2-trimethylpiperidine-2-carbohydrazide?
The InChIKey is JJCYSJWRKMIJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-9(6-4-5-7-10-9)8(13)11-12(2)3/h10H,4-7H2,1-3H3,(H,11,13).
What are the key properties of N',N',2-trimethylpiperidine-2-carbohydrazide?
N',N',2-trimethylpiperidine-2-carbohydrazide has a molecular weight of 185.27 g/mol, XLogP of 0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N',2-trimethylpiperidine-2-carbohydrazide is sourced from PubChem (CID 104597181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).