1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide

C19H24N4O2 — CID 78874114

IUPAC1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide
SMILESCCc1c(C(=O)N2CCC(C(N)=O)CC2)cnn1Cc1ccccc1
InChIInChI=1S/C19H24N4O2/c1-2-17-16(12-21-23(17)13-14-6-4-3-5-7-14)19(25)22-10-8-15(9-11-22)18(20)24/h3-7,12,15H,2,8-11,13H2,1H3,(H2,20,24)
InChIKeyLLJCNQTXJXIXQZ-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.83
Rot. Bonds5

About 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide

1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide (PubChem CID 78874114) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide
PubChem CID78874114
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide
SMILESCCc1c(C(=O)N2CCC(C(N)=O)CC2)cnn1Cc1ccccc1
InChIInChI=1S/C19H24N4O2/c1-2-17-16(12-21-23(17)13-14-6-4-3-5-7-14)19(25)22-10-8-15(9-11-22)18(20)24/h3-7,12,15H,2,8-11,13H2,1H3,(H2,20,24)
InChIKeyLLJCNQTXJXIXQZ-UHFFFAOYSA-N
XLogP1.83
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-benzyl-5-ethylpyrazole-4-carbonyl)-N-ethylpiperidine-4-carboxamide
CID 78905352
(3R)-1-(1-benzyl-5-ethylpyrazole-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 124610594
[1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 78873697
2-[1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidin-4-yl]-1-pyrrolidin-1-ylethanone
CID 78887521
(1-benzyl-5-ethylpyrazol-4-yl)-(4-benzylpiperazin-1-yl)methanone
CID 78874147
(4-amino-3,3-dimethylpiperidin-1-yl)-(1-benzyl-5-ethylpyrazol-4-yl)methanone
CID 120814271
(1-benzyl-5-ethylpyrazol-4-yl)-piperazin-1-ylmethanone
CID 119402258
(1-benzyl-5-ethylpyrazol-4-yl)-(3,9-diazabicyclo[4.2.1]nonan-3-yl)methanone
CID 119637530
1-[4-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperazin-1-yl]-3-cyclopentylpropan-1-one
CID 78872072
(1-benzyl-5-ethylpyrazol-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 78874237
(1-benzyl-5-ethylpyrazol-4-yl)-[(3R,5R)-3,5-dimethylpiperazin-1-yl]methanone
CID 124589891
(1-benzyl-5-ethylpyrazol-4-yl)-(2-methylmorpholin-4-yl)methanone
CID 78873214

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide (CID 78874114) is 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide is CCc1c(C(=O)N2CCC(C(N)=O)CC2)cnn1Cc1ccccc1.
What is the InChIKey of 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide?
The InChIKey is LLJCNQTXJXIXQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-2-17-16(12-21-23(17)13-14-6-4-3-5-7-14)19(25)22-10-8-15(9-11-22)18(20)24/h3-7,12,15H,2,8-11,13H2,1H3,(H2,20,24).
What are the key properties of 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide?
1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzyl-5-ethylpyrazole-4-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 78874114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).