1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide

C13H21N5O — CID 79260368

IUPAC1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1Cc1cc(NN)ccn1
InChIInChI=1S/C13H21N5O/c1-15-13(19)12-4-2-3-7-18(12)9-11-8-10(17-14)5-6-16-11/h5-6,8,12H,2-4,7,9,14H2,1H3,(H,15,19)(H,16,17)
InChIKeyXYJRXTUUGYQTBX-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.47
Rot. Bonds4

About 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide

1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide (PubChem CID 79260368) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide
PubChem CID79260368
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC Name1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1Cc1cc(NN)ccn1
InChIInChI=1S/C13H21N5O/c1-15-13(19)12-4-2-3-7-18(12)9-11-8-10(17-14)5-6-16-11/h5-6,8,12H,2-4,7,9,14H2,1H3,(H,15,19)(H,16,17)
InChIKeyXYJRXTUUGYQTBX-UHFFFAOYSA-N
XLogP0.47
TPSA83.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'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 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide?
The IUPAC name of 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide (CID 79260368) is 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide?
The canonical SMILES for 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide is CNC(=O)C1CCCCN1Cc1cc(NN)ccn1.
What is the InChIKey of 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide?
The InChIKey is XYJRXTUUGYQTBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-15-13(19)12-4-2-3-7-18(12)9-11-8-10(17-14)5-6-16-11/h5-6,8,12H,2-4,7,9,14H2,1H3,(H,15,19)(H,16,17).
What are the key properties of 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide?
1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.47, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 79260368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).