2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide

C12H18N4O2 — CID 62237538

IUPAC2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
SMILESNNc1cc(C(=O)NCC2CCCCO2)ccn1
InChIInChI=1S/C12H18N4O2/c13-16-11-7-9(4-5-14-11)12(17)15-8-10-3-1-2-6-18-10/h4-5,7,10H,1-3,6,8,13H2,(H,14,16)(H,15,17)
InChIKeyLMOQYHDCFLOHDT-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.67
Rot. Bonds4

About 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide

2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide (PubChem CID 62237538) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
PubChem CID62237538
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
SMILESNNc1cc(C(=O)NCC2CCCCO2)ccn1
InChIInChI=1S/C12H18N4O2/c13-16-11-7-9(4-5-14-11)12(17)15-8-10-3-1-2-6-18-10/h4-5,7,10H,1-3,6,8,13H2,(H,14,16)(H,15,17)
InChIKeyLMOQYHDCFLOHDT-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

N-(cyclopentylmethyl)-2-hydrazinylpyridine-4-carboxamide
CID 62243385
2-fluoro-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 55014520
2-(2,6-dichloroanilino)-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 109167534
6-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
CID 62237897
N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylpyridine-4-carboxamide
CID 62244029
3-amino-N-(oxan-2-ylmethyl)benzamide
CID 55013985
4-amino-3-fluoro-N-(oxan-2-ylmethyl)benzamide
CID 55103122
methyl N-[[4-(oxolan-2-ylmethylcarbamoyl)-2-pyridinyl]methyl]carbamate
CID 112520355
4-N-(furan-2-ylmethyl)-2-N-(oxolan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109083258
2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-(oxolan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109083250
[4-(oxan-2-ylmethoxymethyl)-2-pyridinyl]hydrazine
CID 62463960
N-[2-(4-chlorophenyl)ethyl]-2-(oxolan-2-ylmethylamino)pyridine-4-carboxamide
CID 109167563

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The IUPAC name of 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide (CID 62237538) is 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide is NNc1cc(C(=O)NCC2CCCCO2)ccn1.
What is the InChIKey of 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The InChIKey is LMOQYHDCFLOHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c13-16-11-7-9(4-5-14-11)12(17)15-8-10-3-1-2-6-18-10/h4-5,7,10H,1-3,6,8,13H2,(H,14,16)(H,15,17).
What are the key properties of 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-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 2-hydrazinyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide is sourced from PubChem (CID 62237538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).