1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide

C19H24N4O3 — CID 136524433

IUPAC1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide
SMILESCOCCn1ccc(NC(=O)C2CCCN(C(=O)c3ccccc3)C2)n1
InChIInChI=1S/C19H24N4O3/c1-26-13-12-23-11-9-17(21-23)20-18(24)16-8-5-10-22(14-16)19(25)15-6-3-2-4-7-15/h2-4,6-7,9,11,16H,5,8,10,12-14H2,1H3,(H,20,21,24)
InChIKeyWZDWLTZTTKWFRT-UHFFFAOYSA-N
MW356.43 g/mol
LogP2.02
Rot. Bonds6

About 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide

1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide (PubChem CID 136524433) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide
PubChem CID136524433
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide
SMILESCOCCn1ccc(NC(=O)C2CCCN(C(=O)c3ccccc3)C2)n1
InChIInChI=1S/C19H24N4O3/c1-26-13-12-23-11-9-17(21-23)20-18(24)16-8-5-10-22(14-16)19(25)15-6-3-2-4-7-15/h2-4,6-7,9,11,16H,5,8,10,12-14H2,1H3,(H,20,21,24)
InChIKeyWZDWLTZTTKWFRT-UHFFFAOYSA-N
XLogP2.02
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3S)-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 52639571
1-benzoyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
CID 136524415
N-[1-(2-methoxyethyl)pyrazol-3-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 119314318
1-benzoyl-N-(1-hydroxy-2-methylpropan-2-yl)piperidine-3-carboxamide
CID 110000883
tert-butyl 3-[(1-methylpyrazol-3-yl)carbamoyl]piperidine-1-carboxylate
CID 18152683
propyl 1-benzoylpiperidine-3-carboxylate
CID 57315331
(2S)-2-[(1-benzoylpiperidine-3-carbonyl)amino]propanoic acid
CID 119238223
N-(6-amino-3-pyridinyl)-1-benzoylpiperidine-3-carboxamide
CID 119516397
1-benzoyl-N-(3-tert-butylphenyl)piperidine-3-carboxamide
CID 121381993
1-benzoyl-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)piperidine-3-carboxamide;hydrochloride
CID 120644621
1-benzoyl-N-octylpiperidine-3-carboxamide
CID 70028584
N-(2-amino-2-phenylethyl)-1-benzoylpiperidine-3-carboxamide
CID 119529448

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide?
The IUPAC name of 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide (CID 136524433) is 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide.
What is the SMILES notation for 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide?
The canonical SMILES for 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide is COCCn1ccc(NC(=O)C2CCCN(C(=O)c3ccccc3)C2)n1.
What is the InChIKey of 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide?
The InChIKey is WZDWLTZTTKWFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-26-13-12-23-11-9-17(21-23)20-18(24)16-8-5-10-22(14-16)19(25)15-6-3-2-4-7-15/h2-4,6-7,9,11,16H,5,8,10,12-14H2,1H3,(H,20,21,24).
What are the key properties of 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide?
1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-[1-(2-methoxyethyl)pyrazol-3-yl]piperidine-3-carboxamide is sourced from PubChem (CID 136524433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).