2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate

C10H13N3O3 — CID 174633921

IUPAC2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate
SMILESCC(=O)OCCNNC(=O)c1cccnc1
InChIInChI=1S/C10H13N3O3/c1-8(14)16-6-5-12-13-10(15)9-3-2-4-11-7-9/h2-4,7,12H,5-6H2,1H3,(H,13,15)
InChIKeyKOQKMUBQGAGZIG-UHFFFAOYSA-N
MW223.23 g/mol
LogP-0.12
Rot. Bonds5

About 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate

2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate (PubChem CID 174633921) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate.

Molecular Properties

Compound Name2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate
PubChem CID174633921
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate
SMILESCC(=O)OCCNNC(=O)c1cccnc1
InChIInChI=1S/C10H13N3O3/c1-8(14)16-6-5-12-13-10(15)9-3-2-4-11-7-9/h2-4,7,12H,5-6H2,1H3,(H,13,15)
InChIKeyKOQKMUBQGAGZIG-UHFFFAOYSA-N
XLogP-0.12
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-methylpyridine-3-carboxamide chloride
CID 20976730
N'-(2-amino-2-methylpropanoyl)pyridine-3-carbohydrazide
CID 67519841
ethyl 2,2-dimethyl-1-[(pyridine-3-carbonylamino)carbamoylamino]cyclopropane-1-carboxylate
CID 50906669
2-(pyridine-3-carbonylamino)ethyl 3-methoxybenzoate chloride
CID 21236630
N'-[(2,3,4-trimethoxyphenyl)methyl]pyridine-3-carbohydrazide
CID 155927926
N-(3-bromo-4-methoxybutyl)pyridine-3-carboxamide
CID 106244946
N-[[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]methyl]acetamide
CID 32688575
[1-amino-3-(pyridine-3-carbonylsulfamoyl)propan-2-yl] acetate
CID 141388144
2-(pyridine-3-carbonylamino)ethyl 2-phenylbutanoate
CID 69106862
N-propan-2-yloxypyridine-3-carboxamide;hydrochloride
CID 3028390
N'-(2-phenylprop-1-enyl)pyridine-3-carbohydrazide
CID 4745339
ethyl (E)-3-(pyridine-3-carbonylamino)prop-2-enoate
CID 102078444

Frequently Asked Questions

What is the IUPAC name of 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate?
The IUPAC name of 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate (CID 174633921) is 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate.
What is the SMILES notation for 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate?
The canonical SMILES for 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate is CC(=O)OCCNNC(=O)c1cccnc1.
What is the InChIKey of 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate?
The InChIKey is KOQKMUBQGAGZIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c1-8(14)16-6-5-12-13-10(15)9-3-2-4-11-7-9/h2-4,7,12H,5-6H2,1H3,(H,13,15).
What are the key properties of 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate?
2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate has a molecular weight of 223.23 g/mol, XLogP of -0.12, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl acetate is sourced from PubChem (CID 174633921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).