N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide

C12H22N6O — CID 55050979

IUPACN-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide
SMILESCCN(CC)CC(C)NC(=O)c1ccc(NN)nn1
InChIInChI=1S/C12H22N6O/c1-4-18(5-2)8-9(3)14-12(19)10-6-7-11(15-13)17-16-10/h6-7,9H,4-5,8,13H2,1-3H3,(H,14,19)(H,15,17)
InChIKeyXTYVHVJLWNATAO-UHFFFAOYSA-N
MW266.35 g/mol
LogP0.22
Rot. Bonds7

About N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide

N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide (PubChem CID 55050979) has the molecular formula C12H22N6O and a molecular weight of 266.35 g/mol. Its IUPAC name is N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide
PubChem CID55050979
Molecular FormulaC12H22N6O
Molecular Weight266.35 g/mol
Exact Mass266.19
IUPAC NameN-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide
SMILESCCN(CC)CC(C)NC(=O)c1ccc(NN)nn1
InChIInChI=1S/C12H22N6O/c1-4-18(5-2)8-9(3)14-12(19)10-6-7-11(15-13)17-16-10/h6-7,9H,4-5,8,13H2,1-3H3,(H,14,19)(H,15,17)
InChIKeyXTYVHVJLWNATAO-UHFFFAOYSA-N
XLogP0.22
TPSA96.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 50.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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

6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide
CID 62236681
6-[1-(diethylamino)propan-2-ylamino]pyridazine-3-carboxamide
CID 79098153
N-(1-amino-1-oxopropan-2-yl)-6-hydrazinylpyridazine-3-carboxamide
CID 62242878
6-hydrazinyl-N-(3-methylbutyl)pyridazine-3-carboxamide
CID 62237645
6-hydrazinyl-N,N-bis(2-methylpropyl)pyridazine-3-carboxamide
CID 55052509
6-hydrazinyl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide
CID 106283109
6-hydrazinyl-N-methyl-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 62241728
N-pentan-2-yl-6-(propylamino)pyridazine-3-carboxamide
CID 62185105
N-(1-cyclohexylpropyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62407615
6-hydrazinyl-N-(1-pyridin-2-ylethyl)pyridazine-3-carboxamide
CID 62241752
N-(4-ethylphenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62248142
N-[1-(3-fluorophenyl)ethyl]-6-hydrazinylpyridazine-3-carboxamide
CID 62247886

Frequently Asked Questions

What is the IUPAC name of N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide?
The IUPAC name of N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide (CID 55050979) is N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide.
What is the SMILES notation for N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide?
The canonical SMILES for N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide is CCN(CC)CC(C)NC(=O)c1ccc(NN)nn1.
What is the InChIKey of N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide?
The InChIKey is XTYVHVJLWNATAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6O/c1-4-18(5-2)8-9(3)14-12(19)10-6-7-11(15-13)17-16-10/h6-7,9H,4-5,8,13H2,1-3H3,(H,14,19)(H,15,17).
What are the key properties of N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide?
N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide has a molecular weight of 266.35 g/mol, XLogP of 0.22, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(diethylamino)propan-2-yl]-6-hydrazinylpyridazine-3-carboxamide is sourced from PubChem (CID 55050979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).