6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide

C20H19ClN4O — CID 109120537

IUPAC6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)Nc2cccc(Cl)c2)nn1
InChIInChI=1S/C20H19ClN4O/c1-2-25(14-15-7-4-3-5-8-15)19-12-11-18(23-24-19)20(26)22-17-10-6-9-16(21)13-17/h3-13H,2,14H2,1H3,(H,22,26)
InChIKeyGRZCWCCWPXSVPH-UHFFFAOYSA-N
MW366.85 g/mol
LogP4.41
Rot. Bonds6

About 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide

6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide (PubChem CID 109120537) has the molecular formula C20H19ClN4O and a molecular weight of 366.85 g/mol. Its IUPAC name is 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide
PubChem CID109120537
Molecular FormulaC20H19ClN4O
Molecular Weight366.85 g/mol
Exact Mass366.12
IUPAC Name6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)Nc2cccc(Cl)c2)nn1
InChIInChI=1S/C20H19ClN4O/c1-2-25(14-15-7-4-3-5-8-15)19-12-11-18(23-24-19)20(26)22-17-10-6-9-16(21)13-17/h3-13H,2,14H2,1H3,(H,22,26)
InChIKeyGRZCWCCWPXSVPH-UHFFFAOYSA-N
XLogP4.41
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.85
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[ethyl-[(4-methoxyphenyl)methyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133384179
6-[benzyl(ethyl)amino]-N-pentylpyridazine-3-carboxamide
CID 109120520
N-(3-chlorophenyl)-5-(diethylamino)pyridine-2-carboxamide
CID 109194760
2-[benzyl(ethyl)amino]-N-(4-chlorophenyl)pyridine-4-carboxamide
CID 109171588
N-[6-[benzyl(ethyl)amino]pyridazin-3-yl]-2-chlorobenzamide
CID 113041914
6-[benzyl(ethyl)amino]-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114288
N-(3-chlorophenyl)-5-(diethylamino)pyrazine-2-carboxamide
CID 109286897
2-[benzyl(ethyl)amino]-N-(3-chloro-4-fluorophenyl)pyridine-4-carboxamide
CID 109171589
N-(3-chlorophenyl)-6-[(1,1-dioxothiolan-3-yl)-ethylamino]pyridazine-3-carboxamide
CID 109123676
6-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyrimidine-4-carboxamide
CID 109349422
2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109171593
5-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 109282890

Frequently Asked Questions

What is the IUPAC name of 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide (CID 109120537) is 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide is CCN(Cc1ccccc1)c1ccc(C(=O)Nc2cccc(Cl)c2)nn1.
What is the InChIKey of 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide?
The InChIKey is GRZCWCCWPXSVPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN4O/c1-2-25(14-15-7-4-3-5-8-15)19-12-11-18(23-24-19)20(26)22-17-10-6-9-16(21)13-17/h3-13H,2,14H2,1H3,(H,22,26).
What are the key properties of 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide?
6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide has a molecular weight of 366.85 g/mol, XLogP of 4.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[benzyl(ethyl)amino]-N-(3-chlorophenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109120537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).