N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide

C13H25N3O2 — CID 91577134

IUPACN'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide
SMILESCCCCC(=O)NNC(=O)CC1CCN(C)CC1
InChIInChI=1S/C13H25N3O2/c1-3-4-5-12(17)14-15-13(18)10-11-6-8-16(2)9-7-11/h11H,3-10H2,1-2H3,(H,14,17)(H,15,18)
InChIKeyIUHUHCDHASWOHY-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.06
Rot. Bonds5

About N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide

N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide (PubChem CID 91577134) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide.

Molecular Properties

Compound NameN'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide
PubChem CID91577134
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide
SMILESCCCCC(=O)NNC(=O)CC1CCN(C)CC1
InChIInChI=1S/C13H25N3O2/c1-3-4-5-12(17)14-15-13(18)10-11-6-8-16(2)9-7-11/h11H,3-10H2,1-2H3,(H,14,17)(H,15,18)
InChIKeyIUHUHCDHASWOHY-UHFFFAOYSA-N
XLogP1.06
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.06
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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Related Compounds

2-Methyl-3-piperidin-1-ylpropanohydrazide
CID 3734228
3-(4-Methylpiperidin-1-yl)propanehydrazide
CID 774285
3-methyl-N-(piperidin-1-yl)butanamide
CID 903966
1-Methylpiperidine-4-carbohydrazide
CID 468608
1-Acetylpiperidine-4-carbohydrazide
CID 468609
N'-acetylpiperidine-4-carbohydrazide
CID 470885
2-Methyl-3-(4-methylpiperidin-1-yl)propanehydrazide
CID 3332405
rac-(2R,3R)-1,2-dimethylpiperidine-3-carbohydrazide, cis
CID 124252100
N-piperidylvaleramide
CID 17164287
1-t-Butylpiperidine-4-carbohydrazide
CID 66911321
1-tert-butyl-N'-(3,3,3-trifluoropropanoyl)piperidine-4-carbohydrazide
CID 91248972
N-[2-oxo-4-(2,2,2-trifluoroethyl)piperidin-1-yl]butanamide
CID 118691310

Frequently Asked Questions

What is the IUPAC name of N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide?
The IUPAC name of N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide (CID 91577134) is N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide.
What is the SMILES notation for N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide?
The canonical SMILES for N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide is CCCCC(=O)NNC(=O)CC1CCN(C)CC1.
What is the InChIKey of N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide?
The InChIKey is IUHUHCDHASWOHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-3-4-5-12(17)14-15-13(18)10-11-6-8-16(2)9-7-11/h11H,3-10H2,1-2H3,(H,14,17)(H,15,18).
What are the key properties of N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide?
N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide has a molecular weight of 255.36 g/mol, XLogP of 1.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide is sourced from PubChem (CID 91577134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).