N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide

C13H22N4O2 — CID 55050644

IUPACN-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCCC(C)N(CCOC)C(=O)c1cccc(NN)n1
InChIInChI=1S/C13H22N4O2/c1-4-10(2)17(8-9-19-3)13(18)11-6-5-7-12(15-11)16-14/h5-7,10H,4,8-9,14H2,1-3H3,(H,15,16)
InChIKeyQNYWWCMUECJSOZ-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.25
Rot. Bonds7

About N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide

N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide (PubChem CID 55050644) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide
PubChem CID55050644
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCCC(C)N(CCOC)C(=O)c1cccc(NN)n1
InChIInChI=1S/C13H22N4O2/c1-4-10(2)17(8-9-19-3)13(18)11-6-5-7-12(15-11)16-14/h5-7,10H,4,8-9,14H2,1-3H3,(H,15,16)
InChIKeyQNYWWCMUECJSOZ-UHFFFAOYSA-N
XLogP1.25
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.25
H-Bond Donors ≤ 52
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 N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide?
The IUPAC name of N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide (CID 55050644) is N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide?
The canonical SMILES for N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide is CCC(C)N(CCOC)C(=O)c1cccc(NN)n1.
What is the InChIKey of N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide?
The InChIKey is QNYWWCMUECJSOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-4-10(2)17(8-9-19-3)13(18)11-6-5-7-12(15-11)16-14/h5-7,10H,4,8-9,14H2,1-3H3,(H,15,16).
What are the key properties of N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide?
N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 1.25, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-6-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide is sourced from PubChem (CID 55050644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).