2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide

C13H20ClN5O — CID 63208995

IUPAC2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide
SMILESCN(CCN1CCCC1)C(=O)c1cc(Cl)nc(NN)c1
InChIInChI=1S/C13H20ClN5O/c1-18(6-7-19-4-2-3-5-19)13(20)10-8-11(14)16-12(9-10)17-15/h8-9H,2-7,15H2,1H3,(H,16,17)
InChIKeyVEEZCCLYODVQOR-UHFFFAOYSA-N
MW297.79 g/mol
LogP1.19
Rot. Bonds5

About 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide

2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide (PubChem CID 63208995) has the molecular formula C13H20ClN5O and a molecular weight of 297.79 g/mol. Its IUPAC name is 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide
PubChem CID63208995
Molecular FormulaC13H20ClN5O
Molecular Weight297.79 g/mol
Exact Mass297.14
IUPAC Name2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide
SMILESCN(CCN1CCCC1)C(=O)c1cc(Cl)nc(NN)c1
InChIInChI=1S/C13H20ClN5O/c1-18(6-7-19-4-2-3-5-19)13(20)10-8-11(14)16-12(9-10)17-15/h8-9H,2-7,15H2,1H3,(H,16,17)
InChIKeyVEEZCCLYODVQOR-UHFFFAOYSA-N
XLogP1.19
TPSA74.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.79
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'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 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide (CID 63208995) is 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide is CN(CCN1CCCC1)C(=O)c1cc(Cl)nc(NN)c1.
What is the InChIKey of 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide?
The InChIKey is VEEZCCLYODVQOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN5O/c1-18(6-7-19-4-2-3-5-19)13(20)10-8-11(14)16-12(9-10)17-15/h8-9H,2-7,15H2,1H3,(H,16,17).
What are the key properties of 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide?
2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide has a molecular weight of 297.79 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-hydrazinyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 63208995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).