N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide

C13H21N5O — CID 64915263

IUPACN-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESCCC1CCC(NC(=O)c2ccc(NN)nn2)C1C
InChIInChI=1S/C13H21N5O/c1-3-9-4-5-10(8(9)2)15-13(19)11-6-7-12(16-14)18-17-11/h6-10H,3-5,14H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyWHJJNAVUJXUYHZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.32
Rot. Bonds4

About N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide

N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide (PubChem CID 64915263) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide
PubChem CID64915263
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC NameN-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESCCC1CCC(NC(=O)c2ccc(NN)nn2)C1C
InChIInChI=1S/C13H21N5O/c1-3-9-4-5-10(8(9)2)15-13(19)11-6-7-12(16-14)18-17-11/h6-10H,3-5,14H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyWHJJNAVUJXUYHZ-UHFFFAOYSA-N
XLogP1.32
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.32
H-Bond Donors ≤ 53
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-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide?
The IUPAC name of N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide (CID 64915263) is N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide.
What is the SMILES notation for N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide?
The canonical SMILES for N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide is CCC1CCC(NC(=O)c2ccc(NN)nn2)C1C.
What is the InChIKey of N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide?
The InChIKey is WHJJNAVUJXUYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-3-9-4-5-10(8(9)2)15-13(19)11-6-7-12(16-14)18-17-11/h6-10H,3-5,14H2,1-2H3,(H,15,19)(H,16,18).
What are the key properties of N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide?
N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.32, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide is sourced from PubChem (CID 64915263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).