N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide

C15H22N4O — CID 141463742

IUPACN-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide
SMILESO=C(NCC1CCC1)c1ccc(N2CCCCC2)nn1
InChIInChI=1S/C15H22N4O/c20-15(16-11-12-5-4-6-12)13-7-8-14(18-17-13)19-9-2-1-3-10-19/h7-8,12H,1-6,9-11H2,(H,16,20)
InChIKeyIRCVTLSUVLMGOJ-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.00
Rot. Bonds4

About N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide

N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide (PubChem CID 141463742) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide
PubChem CID141463742
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide
SMILESO=C(NCC1CCC1)c1ccc(N2CCCCC2)nn1
InChIInChI=1S/C15H22N4O/c20-15(16-11-12-5-4-6-12)13-7-8-14(18-17-13)19-9-2-1-3-10-19/h7-8,12H,1-6,9-11H2,(H,16,20)
InChIKeyIRCVTLSUVLMGOJ-UHFFFAOYSA-N
XLogP2.00
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopentylmethyl)-6-(1,3-dihydroisoindol-2-yl)pyridazine-3-carboxamide
CID 141336844
N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide
CID 51107519
N-cyclohexyl-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112450
N-(2-cyclohexyl-3-hydroxypropyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 126806538
N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
CID 119385085
6-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109112480
N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112519
4-[(6-pyrrolidin-1-ylpyridazine-3-carbonyl)amino]butanoic acid
CID 119352616
N-[[(2R,3S)-2-(4-fluorophenyl)oxolan-3-yl]methyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 138031660
[4-(ethylaminomethyl)piperidin-1-yl]-(6-pyrrolidin-1-ylpyridazin-3-yl)methanone
CID 119647808
6-(azepan-1-yl)-N-(pyridin-2-ylmethyl)pyridazine-3-carboxamide
CID 109120839
6-(azepan-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]pyridazine-3-carboxamide
CID 109123466

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide (CID 141463742) is N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide is O=C(NCC1CCC1)c1ccc(N2CCCCC2)nn1.
What is the InChIKey of N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide?
The InChIKey is IRCVTLSUVLMGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c20-15(16-11-12-5-4-6-12)13-7-8-14(18-17-13)19-9-2-1-3-10-19/h7-8,12H,1-6,9-11H2,(H,16,20).
What are the key properties of N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide?
N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide has a molecular weight of 274.37 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide is sourced from PubChem (CID 141463742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).