N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide

C13H21N5O — CID 63999016

IUPACN-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESCC1CCC(NC(=O)c2ccc(NN)nn2)C(C)C1
InChIInChI=1S/C13H21N5O/c1-8-3-4-10(9(2)7-8)15-13(19)11-5-6-12(16-14)18-17-11/h5-6,8-10H,3-4,7,14H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyNQKOCNHSLQAUIU-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.32
Rot. Bonds3

About N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide

N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide (PubChem CID 63999016) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide
PubChem CID63999016
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC NameN-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESCC1CCC(NC(=O)c2ccc(NN)nn2)C(C)C1
InChIInChI=1S/C13H21N5O/c1-8-3-4-10(9(2)7-8)15-13(19)11-5-6-12(16-14)18-17-11/h5-6,8-10H,3-4,7,14H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyNQKOCNHSLQAUIU-UHFFFAOYSA-N
XLogP1.32
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
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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Related Compounds

N-(2,4-dimethylcyclohexyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107378326
6-hydrazinyl-N-(3-methylcyclohexyl)pyridazine-3-carboxamide
CID 62243208
N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyridazine-3-carboxamide
CID 64915263
6-(methylamino)-N-(2-methylcyclopropyl)pyridazine-3-carboxamide
CID 62409624
6-[(2,4-dimethylcyclohexyl)carbamoyl]pyridine-3-carboxylic acid
CID 63997179
N-(2,4-dimethylcyclohexyl)-5-(methylamino)pyridine-2-carboxamide
CID 104641444
6-[(2,4-dimethylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid
CID 63997792
4-carbamothioyl-N-(2,4-dimethylcyclohexyl)benzamide
CID 63999184
6-hydrazinyl-N-[(2-methylcyclohexyl)methyl]pyridazine-3-carboxamide
CID 55052556
6-amino-N-(2-methylcyclopropyl)pyridazine-3-carboxamide
CID 62408857
2-chloro-N-(2,4-dimethylcyclohexyl)furan-3-carboxamide
CID 106686861
2-[(2,4-dimethylcyclohexyl)carbamoyl]pyridine-4-carboxylic acid
CID 122055688

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide?
The IUPAC name of N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide (CID 63999016) is N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide.
What is the SMILES notation for N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide?
The canonical SMILES for N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide is CC1CCC(NC(=O)c2ccc(NN)nn2)C(C)C1.
What is the InChIKey of N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide?
The InChIKey is NQKOCNHSLQAUIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-8-3-4-10(9(2)7-8)15-13(19)11-5-6-12(16-14)18-17-11/h5-6,8-10H,3-4,7,14H2,1-2H3,(H,15,19)(H,16,18).
What are the key properties of N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide?
N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.32, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylcyclohexyl)-6-hydrazinylpyridazine-3-carboxamide is sourced from PubChem (CID 63999016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).