1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide

C14H22N4O — CID 121118861

IUPAC1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(c2ccc(C)nn2)CC1
InChIInChI=1S/C14H22N4O/c1-3-8-15-14(19)12-6-9-18(10-7-12)13-5-4-11(2)16-17-13/h4-5,12H,3,6-10H2,1-2H3,(H,15,19)
InChIKeyZGEZFLQFOFGBAS-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.53
Rot. Bonds4

About 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide

1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide (PubChem CID 121118861) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide
PubChem CID121118861
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(c2ccc(C)nn2)CC1
InChIInChI=1S/C14H22N4O/c1-3-8-15-14(19)12-6-9-18(10-7-12)13-5-4-11(2)16-17-13/h4-5,12H,3,6-10H2,1-2H3,(H,15,19)
InChIKeyZGEZFLQFOFGBAS-UHFFFAOYSA-N
XLogP1.53
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-methylphenoxy)ethyl]-1-(6-methylpyridazin-3-yl)piperidine-4-carboxamide
CID 121118974
1-(6-methylpyridazin-3-yl)-N-propan-2-ylpiperidine-4-carboxamide
CID 121118746
N-[2-(4,5-dimethyl-6-oxopyrimidin-1-yl)ethyl]-1-(6-methylpyridazin-3-yl)piperidine-4-carboxamide
CID 121120955
1-[6-[2-(2,6-difluoroanilino)-2-oxoethyl]sulfanylpyridazin-3-yl]-N-propylpiperidine-4-carboxamide
CID 50826301
N-[2-(4-methylpiperazin-1-yl)ethyl]-1-(6-pyrrolidin-1-ylpyridazin-3-yl)piperidine-4-carboxamide
CID 46297885
1-[6-[2-(2,5-dimethylanilino)-2-oxoethyl]sulfanylpyridazin-3-yl]-N-propylpiperidine-4-carboxamide
CID 50826368
N-[(2-methoxyphenyl)methyl]-1-(6-methylpyridazin-3-yl)piperidine-4-carboxamide
CID 121118870
N-(2,6-dimethylphenyl)-1-(6-methylpyridazin-3-yl)piperidine-4-carboxamide
CID 121118835
N-[2-[3-(3,5-dimethylpyrazol-1-yl)-6-oxopyridazin-1-yl]ethyl]-1-(6-methylpyridazin-3-yl)piperidine-4-carboxamide
CID 121119104
1-[6-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]sulfanylpyridazin-3-yl]-N-propylpiperidine-4-carboxamide
CID 50826298
N-(3-piperidin-1-ylpropyl)-1-(6-pyrrolidin-1-ylpyridazin-3-yl)piperidine-4-carboxamide
CID 50771839
N-(4-fluorophenyl)-1-(6-methylpyridazin-3-yl)piperidine-4-carboxamide
CID 121118787

Frequently Asked Questions

What is the IUPAC name of 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide?
The IUPAC name of 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide (CID 121118861) is 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide?
The canonical SMILES for 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide is CCCNC(=O)C1CCN(c2ccc(C)nn2)CC1.
What is the InChIKey of 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide?
The InChIKey is ZGEZFLQFOFGBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-3-8-15-14(19)12-6-9-18(10-7-12)13-5-4-11(2)16-17-13/h4-5,12H,3,6-10H2,1-2H3,(H,15,19).
What are the key properties of 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide?
1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methylpyridazin-3-yl)-N-propylpiperidine-4-carboxamide is sourced from PubChem (CID 121118861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).