N'-propanoylpiperidine-4-carbohydrazide

C9H17N3O2 — CID 82112301

IUPACN'-propanoylpiperidine-4-carbohydrazide
SMILESCCC(=O)NNC(=O)C1CCNCC1
InChIInChI=1S/C9H17N3O2/c1-2-8(13)11-12-9(14)7-3-5-10-6-4-7/h7,10H,2-6H2,1H3,(H,11,13)(H,12,14)
InChIKeySOOFGAAPJRUTPW-UHFFFAOYSA-N
MW199.25 g/mol
LogP-0.46
Rot. Bonds2

About N'-propanoylpiperidine-4-carbohydrazide

N'-propanoylpiperidine-4-carbohydrazide (PubChem CID 82112301) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is N'-propanoylpiperidine-4-carbohydrazide.

Molecular Properties

Compound NameN'-propanoylpiperidine-4-carbohydrazide
PubChem CID82112301
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC NameN'-propanoylpiperidine-4-carbohydrazide
SMILESCCC(=O)NNC(=O)C1CCNCC1
InChIInChI=1S/C9H17N3O2/c1-2-8(13)11-12-9(14)7-3-5-10-6-4-7/h7,10H,2-6H2,1H3,(H,11,13)(H,12,14)
InChIKeySOOFGAAPJRUTPW-UHFFFAOYSA-N
XLogP-0.46
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-phenylacetyl)piperidine-4-carbohydrazide
CID 82121690
N-[4-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 43708676
3-methyl-N'-propanoylcyclobutane-1-carbohydrazide
CID 131131894
N-[3-(butan-2-ylamino)-3-oxopropyl]piperidine-4-carboxamide
CID 54901063
N-[3-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 54794417
N-ethoxypiperidine-4-carboxamide
CID 64974737
N-(3-ethylpentan-2-yl)piperidine-4-carboxamide
CID 63842489
1-piperidin-4-ylpropan-1-one;hydroiodide
CID 142277928
N-(aminomethyl)piperidine-4-carboxamide;ethane
CID 167467064
N-(5-methylhexan-2-yl)piperidine-4-carboxamide;hydrochloride
CID 119263583
N-(2-ethylbutyl)piperidine-4-carboxamide
CID 115733723
N-[1-(ethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide
CID 43579241

Frequently Asked Questions

What is the IUPAC name of N'-propanoylpiperidine-4-carbohydrazide?
The IUPAC name of N'-propanoylpiperidine-4-carbohydrazide (CID 82112301) is N'-propanoylpiperidine-4-carbohydrazide.
What is the SMILES notation for N'-propanoylpiperidine-4-carbohydrazide?
The canonical SMILES for N'-propanoylpiperidine-4-carbohydrazide is CCC(=O)NNC(=O)C1CCNCC1.
What is the InChIKey of N'-propanoylpiperidine-4-carbohydrazide?
The InChIKey is SOOFGAAPJRUTPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-2-8(13)11-12-9(14)7-3-5-10-6-4-7/h7,10H,2-6H2,1H3,(H,11,13)(H,12,14).
What are the key properties of N'-propanoylpiperidine-4-carbohydrazide?
N'-propanoylpiperidine-4-carbohydrazide has a molecular weight of 199.25 g/mol, XLogP of -0.46, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-propanoylpiperidine-4-carbohydrazide is sourced from PubChem (CID 82112301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).