N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide

C20H25N5O2 — CID 109112411

IUPACN-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(Nc2ccccc2N2CCOCC2)nn1
InChIInChI=1S/C20H25N5O2/c26-20(21-15-5-1-2-6-15)17-9-10-19(24-23-17)22-16-7-3-4-8-18(16)25-11-13-27-14-12-25/h3-4,7-10,15H,1-2,5-6,11-14H2,(H,21,26)(H,22,24)
InChIKeyXZFBNMPQGMCNRB-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.73
Rot. Bonds5

About N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide

N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide (PubChem CID 109112411) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide
PubChem CID109112411
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC NameN-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(Nc2ccccc2N2CCOCC2)nn1
InChIInChI=1S/C20H25N5O2/c26-20(21-15-5-1-2-6-15)17-9-10-19(24-23-17)22-16-7-3-4-8-18(16)25-11-13-27-14-12-25/h3-4,7-10,15H,1-2,5-6,11-14H2,(H,21,26)(H,22,24)
InChIKeyXZFBNMPQGMCNRB-UHFFFAOYSA-N
XLogP2.73
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-cyclohexyl-3-[6-(2-morpholin-4-ylanilino)pyridazin-3-yl]urea
CID 113049830
N-cyclohexyl-2-methyl-6-(2-morpholin-4-ylanilino)pyrimidine-4-carboxamide
CID 109364061
6-(2-morpholin-4-ylanilino)-N-propylpyridazine-3-carboxamide
CID 109109357
6-anilino-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide
CID 109126611
N-methyl-6-(2-morpholin-4-ylanilino)-N-phenylpyridazine-3-carboxamide
CID 109127275
6-(4-fluoroanilino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide
CID 109128495
N-cyclohexyl-6-(2-morpholin-4-ylethylamino)pyridazine-3-carboxamide
CID 109112985
N-cyclopentyl-6-(2-phenoxyanilino)pyridazine-3-carboxamide
CID 109112427
2-N-cyclopropyl-4-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
CID 109078752
N-cycloheptyl-3-(2-morpholin-4-ylanilino)propanamide
CID 109031514
N-cycloheptyl-6-(2,4-difluoroanilino)pyridazine-3-carboxamide
CID 109125066
N-cyclohexyl-6-(2,4-difluoroanilino)pyridazine-3-carboxamide
CID 109113119

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide?
The IUPAC name of N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide (CID 109112411) is N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide is O=C(NC1CCCC1)c1ccc(Nc2ccccc2N2CCOCC2)nn1.
What is the InChIKey of N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide?
The InChIKey is XZFBNMPQGMCNRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c26-20(21-15-5-1-2-6-15)17-9-10-19(24-23-17)22-16-7-3-4-8-18(16)25-11-13-27-14-12-25/h3-4,7-10,15H,1-2,5-6,11-14H2,(H,21,26)(H,22,24).
What are the key properties of N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide?
N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide has a molecular weight of 367.45 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-(2-morpholin-4-ylanilino)pyridazine-3-carboxamide is sourced from PubChem (CID 109112411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).