[4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone

C14H24N4O — CID 115304418

IUPAC[4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
SMILESCNC1(C)CCN(C(=O)c2c(C)nn(C)c2C)CC1
InChIInChI=1S/C14H24N4O/c1-10-12(11(2)17(5)16-10)13(19)18-8-6-14(3,15-4)7-9-18/h15H,6-9H2,1-5H3
InChIKeyCQCDXCMFGOFLMQ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.25
Rot. Bonds2

About [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone

[4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone (PubChem CID 115304418) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone.

Molecular Properties

Compound Name[4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
PubChem CID115304418
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name[4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
SMILESCNC1(C)CCN(C(=O)c2c(C)nn(C)c2C)CC1
InChIInChI=1S/C14H24N4O/c1-10-12(11(2)17(5)16-10)13(19)18-8-6-14(3,15-4)7-9-18/h15H,6-9H2,1-5H3
InChIKeyCQCDXCMFGOFLMQ-UHFFFAOYSA-N
XLogP1.25
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-cyclopropylidenepiperidin-1-yl)-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 121184183
[4-(2-aminoethyl)piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 43251610
(2,6-difluoro-3-methylphenyl)-[4-methyl-4-(methylamino)piperidin-1-yl]methanone
CID 82816025
1,3,5-trimethyl-N-(3-methylpyrrolidin-3-yl)pyrazole-4-carboxamide
CID 107422588
[(6S)-2,2,6-trimethylmorpholin-4-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 94202787
(4-ethylphenyl)-[4-(1,3,5-trimethylpyrazole-4-carbonyl)piperazin-1-yl]methanone
CID 33168964
(3-ethyl-1-methylpyrazol-4-yl)-[4-methyl-4-(methylamino)piperidin-1-yl]methanone
CID 102811050
[(3R)-3-methylpiperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 81427482
(4-pyrrolidin-2-ylpiperidin-1-yl)-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 63259075
[4-(3-methyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 71983988
N'-hydroxy-2-[4-(1,3,5-trimethylpyrazole-4-carbonyl)piperazin-1-yl]ethanimidamide
CID 77011990
[4-[6-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 122334122

Frequently Asked Questions

What is the IUPAC name of [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone?
The IUPAC name of [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone (CID 115304418) is [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone.
What is the SMILES notation for [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone?
The canonical SMILES for [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone is CNC1(C)CCN(C(=O)c2c(C)nn(C)c2C)CC1.
What is the InChIKey of [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone?
The InChIKey is CQCDXCMFGOFLMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10-12(11(2)17(5)16-10)13(19)18-8-6-14(3,15-4)7-9-18/h15H,6-9H2,1-5H3.
What are the key properties of [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone?
[4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone has a molecular weight of 264.37 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-4-(methylamino)piperidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone is sourced from PubChem (CID 115304418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).