6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide

C12H18N4O2 — CID 62237897

IUPAC6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
SMILESNNc1cccc(C(=O)NCC2CCCCO2)n1
InChIInChI=1S/C12H18N4O2/c13-16-11-6-3-5-10(15-11)12(17)14-8-9-4-1-2-7-18-9/h3,5-6,9H,1-2,4,7-8,13H2,(H,14,17)(H,15,16)
InChIKeyWFQKFSCCXDACBP-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.67
Rot. Bonds4

About 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide

6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 62237897) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
PubChem CID62237897
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
SMILESNNc1cccc(C(=O)NCC2CCCCO2)n1
InChIInChI=1S/C12H18N4O2/c13-16-11-6-3-5-10(15-11)12(17)14-8-9-4-1-2-7-18-9/h3,5-6,9H,1-2,4,7-8,13H2,(H,14,17)(H,15,16)
InChIKeyWFQKFSCCXDACBP-UHFFFAOYSA-N
XLogP0.67
TPSA89.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.67
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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Related Compounds

2-N,6-N-bis(oxolan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 4668561
6-(oxolan-2-ylmethylcarbamoylamino)pyridine-2-carboxamide
CID 167876369
6-N-tert-butyl-2-N-(oxolan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109096177
2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 62237538
2-N-(3-methylbutyl)-6-N-(oxolan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109096180
6-N-(3-chlorophenyl)-2-N-(oxolan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109096215
6-N-(oxolan-2-ylmethyl)-2-N-(3-phenylpropyl)pyridine-2,6-dicarboxamide
CID 109096175
6-(4-acetylpiperazine-1-carbonyl)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 109096136
3-amino-N-(oxan-2-ylmethyl)benzamide
CID 55013985
6-[[(2S)-oxolan-2-yl]methylamino]pyridine-2-carboxylic acid
CID 94378458
6-(4-methylpiperazine-1-carbonyl)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 109096133
2-N-[(3-methylphenyl)methyl]-6-N-(oxolan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109096140

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide (CID 62237897) is 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide is NNc1cccc(C(=O)NCC2CCCCO2)n1.
What is the InChIKey of 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is WFQKFSCCXDACBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c13-16-11-6-3-5-10(15-11)12(17)14-8-9-4-1-2-7-18-9/h3,5-6,9H,1-2,4,7-8,13H2,(H,14,17)(H,15,16).
What are the key properties of 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide?
6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.67, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62237897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).