1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide

C11H22N4O2 — CID 63584988

IUPAC1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(CCCC(=O)NN)CC1
InChIInChI=1S/C11H22N4O2/c1-13-11(17)9-4-7-15(8-5-9)6-2-3-10(16)14-12/h9H,2-8,12H2,1H3,(H,13,17)(H,14,16)
InChIKeyLKSFGEORMLYQAQ-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.79
Rot. Bonds5

About 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide

1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide (PubChem CID 63584988) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide
PubChem CID63584988
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(CCCC(=O)NN)CC1
InChIInChI=1S/C11H22N4O2/c1-13-11(17)9-4-7-15(8-5-9)6-2-3-10(16)14-12/h9H,2-8,12H2,1H3,(H,13,17)(H,14,16)
InChIKeyLKSFGEORMLYQAQ-UHFFFAOYSA-N
XLogP-0.79
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

1-(5-amino-5-sulfanylidenepentyl)-N-methylpiperidine-4-carboxamide
CID 54967141
1-(2-hydroxyethyl)-N-methylpiperidine-4-carboxamide
CID 130917589
4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butanehydrazide
CID 63584815
ethyl 3-[4-(methylcarbamoyl)piperidin-1-yl]propanoate
CID 60705415
4-(4-methylazepan-1-yl)butanehydrazide
CID 63627733
5-(4-hydroxypiperidin-1-yl)pentanehydrazide
CID 63571141
5-[4-(dimethylamino)piperidin-1-yl]pentanehydrazide
CID 55213443
5-(4-ethylpiperidin-1-yl)pentanehydrazide
CID 63578403
1-(4-cyanobutyl)-N-methylpiperidine-4-carboxamide
CID 55136373
N-methyl-4-[4-(methylamino)piperidin-1-yl]butanamide
CID 63891147
1-(2-ethoxyethyl)-N-methylpiperidine-4-carboxamide
CID 134055126
ethane;1-(2-methoxyethyl)-N-methylpiperidine-4-carboxamide
CID 143678079

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide (CID 63584988) is 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide is CNC(=O)C1CCN(CCCC(=O)NN)CC1.
What is the InChIKey of 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide?
The InChIKey is LKSFGEORMLYQAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-13-11(17)9-4-7-15(8-5-9)6-2-3-10(16)14-12/h9H,2-8,12H2,1H3,(H,13,17)(H,14,16).
What are the key properties of 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide?
1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide has a molecular weight of 242.32 g/mol, XLogP of -0.79, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 63584988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).