1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide

C19H24N4O2 — CID 71998614

IUPAC1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide
SMILESCCc1cc(CNC(=O)C2CCN(C(=O)c3ccccc3)CC2)[nH]n1
InChIInChI=1S/C19H24N4O2/c1-2-16-12-17(22-21-16)13-20-18(24)14-8-10-23(11-9-14)19(25)15-6-4-3-5-7-15/h3-7,12,14H,2,8-11,13H2,1H3,(H,20,24)(H,21,22)
InChIKeyUNPZHVUZMKYJSZ-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.14
Rot. Bonds5

About 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide

1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide (PubChem CID 71998614) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide
PubChem CID71998614
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide
SMILESCCc1cc(CNC(=O)C2CCN(C(=O)c3ccccc3)CC2)[nH]n1
InChIInChI=1S/C19H24N4O2/c1-2-16-12-17(22-21-16)13-20-18(24)14-8-10-23(11-9-14)19(25)15-6-4-3-5-7-15/h3-7,12,14H,2,8-11,13H2,1H3,(H,20,24)(H,21,22)
InChIKeyUNPZHVUZMKYJSZ-UHFFFAOYSA-N
XLogP2.14
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzoyl-N-[2-(4-ethylpiperazin-1-yl)ethyl]piperidine-4-carboxamide
CID 154800157
5-[[(1-benzoylpiperidine-4-carbonyl)amino]methyl]thiophene-2-carboxylic acid
CID 122110854
1-benzoyl-N-(2-propan-2-yloxyethyl)piperidine-4-carboxamide
CID 110416664
1-benzoyl-N-pentan-3-ylpiperidine-4-carboxamide
CID 17018973
1-(3-methylbenzoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 113004430
1-benzoyl-N-[2-(methylamino)propyl]piperidine-4-carboxamide
CID 120830387
1-benzoyl-N-[2-(ethylaminomethyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119440143
(2S)-4-benzyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]morpholine-2-carboxamide
CID 95775991
N-benzyl-1-(3,5-dichlorobenzoyl)piperidine-4-carboxamide
CID 41305444
1-benzoyl-N-[2-(1H-indol-2-yl)ethyl]piperidine-4-carboxamide
CID 21030345
1-benzoyl-N-[(2,6-dimethylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)methyl]piperidine-4-carboxamide
CID 53162999
1-benzoyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide
CID 41024910

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide (CID 71998614) is 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide is CCc1cc(CNC(=O)C2CCN(C(=O)c3ccccc3)CC2)[nH]n1.
What is the InChIKey of 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide?
The InChIKey is UNPZHVUZMKYJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-2-16-12-17(22-21-16)13-20-18(24)14-8-10-23(11-9-14)19(25)15-6-4-3-5-7-15/h3-7,12,14H,2,8-11,13H2,1H3,(H,20,24)(H,21,22).
What are the key properties of 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide?
1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 71998614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).