1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide

C13H20N4O2 — CID 110681708

IUPAC1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide
SMILESCCn1nc(C(=O)N2CCC(C(N)=O)CC2)cc1C
InChIInChI=1S/C13H20N4O2/c1-3-17-9(2)8-11(15-17)13(19)16-6-4-10(5-7-16)12(14)18/h8,10H,3-7H2,1-2H3,(H2,14,18)
InChIKeyAEMGDTKCBYVDPO-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.55
Rot. Bonds3

About 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide

1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide (PubChem CID 110681708) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide
PubChem CID110681708
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide
SMILESCCn1nc(C(=O)N2CCC(C(N)=O)CC2)cc1C
InChIInChI=1S/C13H20N4O2/c1-3-17-9(2)8-11(15-17)13(19)16-6-4-10(5-7-16)12(14)18/h8,10H,3-7H2,1-2H3,(H2,14,18)
InChIKeyAEMGDTKCBYVDPO-UHFFFAOYSA-N
XLogP0.55
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-ethyl-5-methylpyrazol-3-yl)-(4-methylpiperidin-1-yl)methanone
CID 42656730
1-[1-(2-fluorophenyl)-5-methylpyrazole-3-carbonyl]piperidine-4-carboxamide
CID 110676727
(1-ethyl-5-methylpyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 110681727
(1-ethyl-5-methylpyrazol-3-yl)-[(3R)-3-[[4-(hydroxymethyl)phenyl]methyl]pyrrolidin-1-yl]methanone
CID 97121185
[4-(1-ethyl-5-methylpyrazole-3-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 110681725
1-[4-[(3,5-dimethylpyrazol-1-yl)methyl]benzoyl]piperidine-4-carboxamide
CID 48981094
(1-ethyl-5-methylpyrazol-3-yl)-[4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-yl]methanone
CID 95709451
[4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-ethyl-5-methylpyrazol-3-yl)methanone
CID 110681721
1-(2-ethyl-5-methylpyrazole-3-carbonyl)-N'-hydroxypiperidine-4-carboximidamide
CID 77113272
1-(2H-triazole-4-carbonyl)piperidine-4-carboxamide
CID 110475443
1-(1-tert-butyl-5-methylpyrazole-3-carbonyl)-N-methylpiperidine-4-carboxamide
CID 53499150
1-[5-(cyclohexanecarbonylamino)-1-methylpyrazole-3-carbonyl]piperidine-4-carboxamide
CID 51999806

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide (CID 110681708) is 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide is CCn1nc(C(=O)N2CCC(C(N)=O)CC2)cc1C.
What is the InChIKey of 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide?
The InChIKey is AEMGDTKCBYVDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-3-17-9(2)8-11(15-17)13(19)16-6-4-10(5-7-16)12(14)18/h8,10H,3-7H2,1-2H3,(H2,14,18).
What are the key properties of 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide?
1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 110681708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).