6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide

C14H16N4O2 — CID 106908801

IUPAC6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide
SMILESNNC(=O)c1cccc(COCCc2ccccn2)n1
InChIInChI=1S/C14H16N4O2/c15-18-14(19)13-6-3-5-12(17-13)10-20-9-7-11-4-1-2-8-16-11/h1-6,8H,7,9-10,15H2,(H,18,19)
InChIKeyWBNGABDQPBZRHE-UHFFFAOYSA-N
MW272.31 g/mol
LogP0.84
Rot. Bonds6

About 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide

6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide (PubChem CID 106908801) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide
PubChem CID106908801
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide
SMILESNNC(=O)c1cccc(COCCc2ccccn2)n1
InChIInChI=1S/C14H16N4O2/c15-18-14(19)13-6-3-5-12(17-13)10-20-9-7-11-4-1-2-8-16-11/h1-6,8H,7,9-10,15H2,(H,18,19)
InChIKeyWBNGABDQPBZRHE-UHFFFAOYSA-N
XLogP0.84
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909041
2-[2-(2-pyridin-2-ylethoxymethyl)phenyl]acetohydrazide
CID 115465175
6-(4,4,4-trifluorobutoxymethyl)pyridine-2-carbohydrazide
CID 106908961
2,2-dimethyl-3-(2-pyridin-2-ylethoxy)propanehydrazide
CID 79628320
6-(pyridin-3-yloxymethyl)pyridine-2-carbohydrazide
CID 106908908
6-[[2-(2-hydroxyethyl)phenoxy]methyl]pyridine-2-carbohydrazide
CID 107714185
6-(2-methylpentoxymethyl)pyridine-2-carbohydrazide
CID 106908991
3-(2-pyridin-2-ylethoxy)propanal
CID 63039480
3-(2-pyridin-2-ylethoxymethyl)benzoic acid
CID 29006188
6-[(3-bromophenoxy)methyl]pyridine-2-carbohydrazide
CID 106908833
6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide
CID 106908803
6-[(2-aminoethylamino)methyl]-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide
CID 10590275

Frequently Asked Questions

What is the IUPAC name of 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide?
The IUPAC name of 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide (CID 106908801) is 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide.
What is the SMILES notation for 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide?
The canonical SMILES for 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide is NNC(=O)c1cccc(COCCc2ccccn2)n1.
What is the InChIKey of 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide?
The InChIKey is WBNGABDQPBZRHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c15-18-14(19)13-6-3-5-12(17-13)10-20-9-7-11-4-1-2-8-16-11/h1-6,8H,7,9-10,15H2,(H,18,19).
What are the key properties of 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide?
6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide has a molecular weight of 272.31 g/mol, XLogP of 0.84, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide is sourced from PubChem (CID 106908801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).