N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide

C17H28N4O — CID 113045130

IUPACN-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide
SMILESCCCN(CCC)c1ccc(NC(=O)C2CCCCC2)nn1
InChIInChI=1S/C17H28N4O/c1-3-12-21(13-4-2)16-11-10-15(19-20-16)18-17(22)14-8-6-5-7-9-14/h10-11,14H,3-9,12-13H2,1-2H3,(H,18,19,22)
InChIKeyNXWWIDQKZVCANS-UHFFFAOYSA-N
MW304.44 g/mol
LogP3.62
Rot. Bonds7

About N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide

N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide (PubChem CID 113045130) has the molecular formula C17H28N4O and a molecular weight of 304.44 g/mol. Its IUPAC name is N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide
PubChem CID113045130
Molecular FormulaC17H28N4O
Molecular Weight304.44 g/mol
Exact Mass304.23
IUPAC NameN-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide
SMILESCCCN(CCC)c1ccc(NC(=O)C2CCCCC2)nn1
InChIInChI=1S/C17H28N4O/c1-3-12-21(13-4-2)16-11-10-15(19-20-16)18-17(22)14-8-6-5-7-9-14/h10-11,14H,3-9,12-13H2,1-2H3,(H,18,19,22)
InChIKeyNXWWIDQKZVCANS-UHFFFAOYSA-N
XLogP3.62
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-3-[6-(dipropylamino)pyridazin-3-yl]urea
CID 113045192
N-[6-(butan-2-ylamino)pyridazin-3-yl]cyclohexanecarboxamide
CID 113038564
N-[6-[butyl(methyl)amino]pyridazin-3-yl]oxane-4-carboxamide
CID 113044823
2-(4-bromophenyl)-N-[6-(dipropylamino)pyridazin-3-yl]acetamide
CID 113045186
N-[6-(diethylamino)pyridazin-3-yl]oxolane-2-carboxamide
CID 113043959
6-(cyclopentanecarbonylamino)-2-(dipropylamino)quinoline-4-carboxylic acid
CID 46326852
N-[6-(dipropylamino)pyridazin-3-yl]-2-phenoxyacetamide
CID 113045161
N-[6-(4-methylanilino)pyridazin-3-yl]cyclohexanecarboxamide
CID 113045805
N-[6-(dipropylamino)pyridazin-3-yl]-1,3-benzodioxole-5-carboxamide
CID 113045169
2-chloro-N-[6-(dipropylamino)pyridazin-3-yl]-6-fluorobenzamide
CID 113045170
N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide
CID 113042823
4-(cyclohexanecarbonylamino)-N,N-dipropylbenzamide
CID 17196139

Frequently Asked Questions

What is the IUPAC name of N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide?
The IUPAC name of N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide (CID 113045130) is N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide is CCCN(CCC)c1ccc(NC(=O)C2CCCCC2)nn1.
What is the InChIKey of N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide?
The InChIKey is NXWWIDQKZVCANS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O/c1-3-12-21(13-4-2)16-11-10-15(19-20-16)18-17(22)14-8-6-5-7-9-14/h10-11,14H,3-9,12-13H2,1-2H3,(H,18,19,22).
What are the key properties of N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide?
N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide has a molecular weight of 304.44 g/mol, XLogP of 3.62, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide is sourced from PubChem (CID 113045130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).