3-piperidin-1-ylpropanehydrazide

C8H17N3O — CID 776458

IUPAC3-piperidin-1-ylpropanehydrazide
SMILESNNC(=O)CCN1CCCCC1
InChIInChI=1S/C8H17N3O/c9-10-8(12)4-7-11-5-2-1-3-6-11/h1-7,9H2,(H,10,12)
InChIKeyAWVBNMXEAMVLLQ-UHFFFAOYSA-N
MW171.24 g/mol
LogP-0.15
Rot. Bonds3

About 3-piperidin-1-ylpropanehydrazide

3-piperidin-1-ylpropanehydrazide (PubChem CID 776458) has the molecular formula C8H17N3O and a molecular weight of 171.24 g/mol. Its IUPAC name is 3-piperidin-1-ylpropanehydrazide.

Molecular Properties

Compound Name3-piperidin-1-ylpropanehydrazide
PubChem CID776458
Molecular FormulaC8H17N3O
Molecular Weight171.24 g/mol
Exact Mass171.14
IUPAC Name3-piperidin-1-ylpropanehydrazide
SMILESNNC(=O)CCN1CCCCC1
InChIInChI=1S/C8H17N3O/c9-10-8(12)4-7-11-5-2-1-3-6-11/h1-7,9H2,(H,10,12)
InChIKeyAWVBNMXEAMVLLQ-UHFFFAOYSA-N
XLogP-0.15
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
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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Related Compounds

2-Methyl-3-piperidin-1-ylpropanohydrazide
CID 3734228
3-(Piperidin-1-yl)propanamide
CID 566784
3-(4-Methylpiperidin-1-yl)propanehydrazide
CID 774285
N'-(N-methyl-4-piperidyl)acetohydrazide
CID 76046
3-(4-Methylpiperazin-1-yl)propanehydrazide
CID 2400453
1-Pentyldiazinan-3-one
CID 44277102
2-Methyl-3-(4-methylpiperidin-1-yl)propanehydrazide
CID 3332405
3-(2,6-Dimethylpiperidin-1-yl)propanehydrazide
CID 3792022
N-piperidylvaleramide
CID 17164287
3-[4-(Trifluoromethyl)piperidin-1-yl]propanehydrazide
CID 65545604
3-[3-(Trifluoromethyl)piperidin-1-yl]propanehydrazide
CID 65545833
3-(3,3-Difluoropiperidin-1-yl)propanehydrazide
CID 164657436

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-ylpropanehydrazide?
The IUPAC name of 3-piperidin-1-ylpropanehydrazide (CID 776458) is 3-piperidin-1-ylpropanehydrazide.
What is the SMILES notation for 3-piperidin-1-ylpropanehydrazide?
The canonical SMILES for 3-piperidin-1-ylpropanehydrazide is NNC(=O)CCN1CCCCC1.
What is the InChIKey of 3-piperidin-1-ylpropanehydrazide?
The InChIKey is AWVBNMXEAMVLLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O/c9-10-8(12)4-7-11-5-2-1-3-6-11/h1-7,9H2,(H,10,12).
What are the key properties of 3-piperidin-1-ylpropanehydrazide?
3-piperidin-1-ylpropanehydrazide has a molecular weight of 171.24 g/mol, XLogP of -0.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-ylpropanehydrazide is sourced from PubChem (CID 776458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).