N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide

C10H21N3O — CID 116845050

IUPACN-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide
SMILESCN1CCCC(CCC(=O)N(C)N)C1
InChIInChI=1S/C10H21N3O/c1-12-7-3-4-9(8-12)5-6-10(14)13(2)11/h9H,3-8,11H2,1-2H3
InChIKeyZUZSAKSNGZHTOZ-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.44
Rot. Bonds3

About N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide

N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide (PubChem CID 116845050) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide.

Molecular Properties

Compound NameN-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide
PubChem CID116845050
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide
SMILESCN1CCCC(CCC(=O)N(C)N)C1
InChIInChI=1S/C10H21N3O/c1-12-7-3-4-9(8-12)5-6-10(14)13(2)11/h9H,3-8,11H2,1-2H3
InChIKeyZUZSAKSNGZHTOZ-UHFFFAOYSA-N
XLogP0.44
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide?
The IUPAC name of N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide (CID 116845050) is N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide.
What is the SMILES notation for N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide?
The canonical SMILES for N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide is CN1CCCC(CCC(=O)N(C)N)C1.
What is the InChIKey of N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide?
The InChIKey is ZUZSAKSNGZHTOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-12-7-3-4-9(8-12)5-6-10(14)13(2)11/h9H,3-8,11H2,1-2H3.
What are the key properties of N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide?
N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide has a molecular weight of 199.30 g/mol, XLogP of 0.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide is sourced from PubChem (CID 116845050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).