N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide

C18H23N5O — CID 109110139

IUPACN-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide
SMILESCCN(CC)c1ccc(Nc2ccc(C(=O)NC3CC3)nn2)cc1
InChIInChI=1S/C18H23N5O/c1-3-23(4-2)15-9-7-13(8-10-15)19-17-12-11-16(21-22-17)18(24)20-14-5-6-14/h7-12,14H,3-6H2,1-2H3,(H,19,22)(H,20,24)
InChIKeyQKTIOJFLIYWUNM-UHFFFAOYSA-N
MW325.42 g/mol
LogP2.96
Rot. Bonds7

About N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide

N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide (PubChem CID 109110139) has the molecular formula C18H23N5O and a molecular weight of 325.42 g/mol. Its IUPAC name is N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide
PubChem CID109110139
Molecular FormulaC18H23N5O
Molecular Weight325.42 g/mol
Exact Mass325.19
IUPAC NameN-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide
SMILESCCN(CC)c1ccc(Nc2ccc(C(=O)NC3CC3)nn2)cc1
InChIInChI=1S/C18H23N5O/c1-3-23(4-2)15-9-7-13(8-10-15)19-17-12-11-16(21-22-17)18(24)20-14-5-6-14/h7-12,14H,3-6H2,1-2H3,(H,19,22)(H,20,24)
InChIKeyQKTIOJFLIYWUNM-UHFFFAOYSA-N
XLogP2.96
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(cyclopropylamino)-N-[4-(diethylamino)phenyl]pyridazine-3-carboxamide
CID 109109943
N-cyclopentyl-6-[4-(dimethylamino)anilino]pyridazine-3-carboxamide
CID 109112406
1-cyclohexyl-3-[6-[4-(diethylamino)anilino]pyridazin-3-yl]urea
CID 113049683
6-[4-(diethylamino)anilino]-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109121704
N-cyclopropyl-2-[4-(diethylamino)anilino]pyrimidine-4-carboxamide
CID 109295866
6-(4-cyanoanilino)-N-cyclopropylpyridazine-3-carboxamide
CID 109110178
6-[4-(diethylamino)anilino]-N,N-dipropylpyridazine-3-carboxamide
CID 109126267
6-(4-chloroanilino)-N-cyclopentylpyridazine-3-carboxamide
CID 109112372
N-cyclopropyl-2-[4-(diethylamino)anilino]pyrimidine-5-carboxamide
CID 109247409
N-cyclohexyl-4-[4-(diethylamino)anilino]pyridine-2-carboxamide
CID 109204867
1-N-cyclopropyl-4-N-[4-(diethylamino)phenyl]benzene-1,4-dicarboxamide
CID 109043408
6-[4-(diethylamino)anilino]-N-(pyridin-3-ylmethyl)pyridazine-3-carboxamide
CID 109121189

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide?
The IUPAC name of N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide (CID 109110139) is N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide is CCN(CC)c1ccc(Nc2ccc(C(=O)NC3CC3)nn2)cc1.
What is the InChIKey of N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide?
The InChIKey is QKTIOJFLIYWUNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O/c1-3-23(4-2)15-9-7-13(8-10-15)19-17-12-11-16(21-22-17)18(24)20-14-5-6-14/h7-12,14H,3-6H2,1-2H3,(H,19,22)(H,20,24).
What are the key properties of N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide?
N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide has a molecular weight of 325.42 g/mol, XLogP of 2.96, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-[4-(diethylamino)anilino]pyridazine-3-carboxamide is sourced from PubChem (CID 109110139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).