N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide

C14H23N5O — CID 62407615

IUPACN-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESCCC(NC(=O)c1ccc(NN)nn1)C1CCCCC1
InChIInChI=1S/C14H23N5O/c1-2-11(10-6-4-3-5-7-10)16-14(20)12-8-9-13(17-15)19-18-12/h8-11H,2-7,15H2,1H3,(H,16,20)(H,17,19)
InChIKeySJHKHVYBUSVTRK-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.85
Rot. Bonds5

About N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide

N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide (PubChem CID 62407615) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide
PubChem CID62407615
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC NameN-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESCCC(NC(=O)c1ccc(NN)nn1)C1CCCCC1
InChIInChI=1S/C14H23N5O/c1-2-11(10-6-4-3-5-7-10)16-14(20)12-8-9-13(17-15)19-18-12/h8-11H,2-7,15H2,1H3,(H,16,20)(H,17,19)
InChIKeySJHKHVYBUSVTRK-UHFFFAOYSA-N
XLogP1.85
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.85
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-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide?
The IUPAC name of N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide (CID 62407615) is N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide.
What is the SMILES notation for N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide?
The canonical SMILES for N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide is CCC(NC(=O)c1ccc(NN)nn1)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide?
The InChIKey is SJHKHVYBUSVTRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-2-11(10-6-4-3-5-7-10)16-14(20)12-8-9-13(17-15)19-18-12/h8-11H,2-7,15H2,1H3,(H,16,20)(H,17,19).
What are the key properties of N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide?
N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.85, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide is sourced from PubChem (CID 62407615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).