6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide

C16H26N4O — CID 109112877

IUPAC6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide
SMILESCC(C)CCNC(=O)c1ccc(NC2CCCCC2)nn1
InChIInChI=1S/C16H26N4O/c1-12(2)10-11-17-16(21)14-8-9-15(20-19-14)18-13-6-4-3-5-7-13/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,17,21)(H,18,20)
InChIKeyADIIYFXEPZBZRD-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.00
Rot. Bonds6

About 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide

6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide (PubChem CID 109112877) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide
PubChem CID109112877
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide
SMILESCC(C)CCNC(=O)c1ccc(NC2CCCCC2)nn1
InChIInChI=1S/C16H26N4O/c1-12(2)10-11-17-16(21)14-8-9-15(20-19-14)18-13-6-4-3-5-7-13/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,17,21)(H,18,20)
InChIKeyADIIYFXEPZBZRD-UHFFFAOYSA-N
XLogP3.00
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-6-(cyclohexylamino)pyridazine-3-carboxamide
CID 109112809
6-(cycloheptylamino)-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109121643
6-(cyclopropylamino)-N-propylpyridazine-3-carboxamide
CID 109109200
N-butan-2-yl-6-(cyclohexylamino)pyridazine-3-carboxamide
CID 109111540
6-(cycloheptylamino)-N-cyclopropylpyridazine-3-carboxamide
CID 109110063
N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide
CID 109112077
6-(cycloheptylamino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
CID 109124661
6-hydrazinyl-N-(3-methylbutyl)pyridazine-3-carboxamide
CID 62237645
6-(cyclopentylamino)-N-[2-(4-methoxyphenyl)ethyl]pyridazine-3-carboxamide
CID 109112117
6-(cyclopentylamino)-N-[(2-methylphenyl)methyl]pyridazine-3-carboxamide
CID 109112095
6-(cyclooctylamino)pyridazine-3-carboxylic acid
CID 60792420
6-(cyclopentylamino)-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109112110

Frequently Asked Questions

What is the IUPAC name of 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide (CID 109112877) is 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide is CC(C)CCNC(=O)c1ccc(NC2CCCCC2)nn1.
What is the InChIKey of 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide?
The InChIKey is ADIIYFXEPZBZRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12(2)10-11-17-16(21)14-8-9-15(20-19-14)18-13-6-4-3-5-7-13/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,17,21)(H,18,20).
What are the key properties of 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide?
6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 3.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109112877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).