N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide

C15H24N4O — CID 109112519

IUPACN-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide
SMILESCCCCCNC(=O)c1ccc(N2CCCCC2)nn1
InChIInChI=1S/C15H24N4O/c1-2-3-5-10-16-15(20)13-8-9-14(18-17-13)19-11-6-4-7-12-19/h8-9H,2-7,10-12H2,1H3,(H,16,20)
InChIKeyCHESVRBCIRWNAW-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.39
Rot. Bonds6

About N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide

N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide (PubChem CID 109112519) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide
PubChem CID109112519
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide
SMILESCCCCCNC(=O)c1ccc(N2CCCCC2)nn1
InChIInChI=1S/C15H24N4O/c1-2-3-5-10-16-15(20)13-8-9-14(18-17-13)19-11-6-4-7-12-19/h8-9H,2-7,10-12H2,1H3,(H,16,20)
InChIKeyCHESVRBCIRWNAW-UHFFFAOYSA-N
XLogP2.39
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-pentyl-6-(4-phenylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109123098
4-[(6-pyrrolidin-1-ylpyridazine-3-carbonyl)amino]butanoic acid
CID 119352616
N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
CID 119385085
N-pentyl-5-piperidin-1-ylpyrazine-2-carboxamide
CID 109274518
N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide
CID 11698083
4-(azepan-1-yl)-N-pentylpyridine-2-carboxamide
CID 109217503
2-methyl-N-pentyl-6-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 109362764
N-cyclohexyl-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112450
6-(azepan-1-yl)-N-[2-(3-chlorophenyl)ethyl]pyridazine-3-carboxamide
CID 109126321
N-heptyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide
CID 67012400
N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide
CID 141463742
N-pentyl-2-phenyl-6-piperidin-1-ylpyrimidine-4-carboxamide
CID 112852907

Frequently Asked Questions

What is the IUPAC name of N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide?
The IUPAC name of N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide (CID 109112519) is N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide?
The canonical SMILES for N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide is CCCCCNC(=O)c1ccc(N2CCCCC2)nn1.
What is the InChIKey of N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide?
The InChIKey is CHESVRBCIRWNAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-3-5-10-16-15(20)13-8-9-14(18-17-13)19-11-6-4-7-12-19/h8-9H,2-7,10-12H2,1H3,(H,16,20).
What are the key properties of N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide?
N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide is sourced from PubChem (CID 109112519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).