3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide

C13H19ClN4O — CID 62243034

IUPAC3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide
SMILESCCN(C(=O)c1nc(NN)ccc1Cl)C1CCCC1
InChIInChI=1S/C13H19ClN4O/c1-2-18(9-5-3-4-6-9)13(19)12-10(14)7-8-11(16-12)17-15/h7-9H,2-6,15H2,1H3,(H,16,17)
InChIKeyXMIZCDQQOXQMLZ-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.43
Rot. Bonds4

About 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide

3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide (PubChem CID 62243034) has the molecular formula C13H19ClN4O and a molecular weight of 282.77 g/mol. Its IUPAC name is 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide
PubChem CID62243034
Molecular FormulaC13H19ClN4O
Molecular Weight282.77 g/mol
Exact Mass282.12
IUPAC Name3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide
SMILESCCN(C(=O)c1nc(NN)ccc1Cl)C1CCCC1
InChIInChI=1S/C13H19ClN4O/c1-2-18(9-5-3-4-6-9)13(19)12-10(14)7-8-11(16-12)17-15/h7-9H,2-6,15H2,1H3,(H,16,17)
InChIKeyXMIZCDQQOXQMLZ-UHFFFAOYSA-N
XLogP2.43
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide (CID 62243034) is 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide is CCN(C(=O)c1nc(NN)ccc1Cl)C1CCCC1.
What is the InChIKey of 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide?
The InChIKey is XMIZCDQQOXQMLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN4O/c1-2-18(9-5-3-4-6-9)13(19)12-10(14)7-8-11(16-12)17-15/h7-9H,2-6,15H2,1H3,(H,16,17).
What are the key properties of 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide?
3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-cyclopentyl-N-ethyl-6-hydrazinylpyridine-2-carboxamide is sourced from PubChem (CID 62243034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).