N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide

C19H26N4O — CID 119069345

IUPACN-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide
SMILESCCN(Cc1ccccc1)C(=O)Cn1nccc1C1CCCNC1
InChIInChI=1S/C19H26N4O/c1-2-22(14-16-7-4-3-5-8-16)19(24)15-23-18(10-12-21-23)17-9-6-11-20-13-17/h3-5,7-8,10,12,17,20H,2,6,9,11,13-15H2,1H3
InChIKeyZKROOFWPOGMTQC-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.40
Rot. Bonds6

About N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide

N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide (PubChem CID 119069345) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide
PubChem CID119069345
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC NameN-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide
SMILESCCN(Cc1ccccc1)C(=O)Cn1nccc1C1CCCNC1
InChIInChI=1S/C19H26N4O/c1-2-22(14-16-7-4-3-5-8-16)19(24)15-23-18(10-12-21-23)17-9-6-11-20-13-17/h3-5,7-8,10,12,17,20H,2,6,9,11,13-15H2,1H3
InChIKeyZKROOFWPOGMTQC-UHFFFAOYSA-N
XLogP2.40
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[5-[(3S)-piperidin-3-yl]pyrazol-1-yl]-N-[(3-pyrazol-1-ylphenyl)methyl]acetamide
CID 126440496
N-butyl-2-(5-piperidin-3-ylpyrazol-1-yl)-N-(thiophen-3-ylmethyl)acetamide;hydrochloride
CID 154905007
3-(2-benzylpyrazol-3-yl)piperidine
CID 83392632
N-[(1-methylimidazol-2-yl)methyl]-2-[5-[(3R)-piperidin-3-yl]pyrazol-1-yl]-N-propylacetamide
CID 126425206
1-(4-benzylpiperidin-1-yl)-2-(5-piperidin-3-ylpyrazol-1-yl)ethanone;hydrochloride
CID 154903726
N-[2-(butylamino)-2-oxoethyl]-N-methyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide
CID 119058801
1-(4-phenylmethoxypiperidin-1-yl)-2-(5-piperidin-3-ylpyrazol-1-yl)ethanone;hydrochloride
CID 154906009
N-methyl-2-(5-piperidin-3-ylpyrazol-1-yl)-N-[(4-propan-2-yl-1,2,4-triazol-3-yl)methyl]acetamide;hydrochloride
CID 154903847
1-(azepan-1-yl)-2-[5-[(3S)-piperidin-3-yl]pyrazol-1-yl]ethanone
CID 126426759
1-(azocan-1-yl)-2-(5-piperidin-3-ylpyrazol-1-yl)ethanone;hydrochloride
CID 154903731
N-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-2-[5-[(3R)-piperidin-3-yl]pyrazol-1-yl]acetamide
CID 126445012
N-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-2-[5-[(3S)-piperidin-3-yl]pyrazol-1-yl]acetamide
CID 126445011

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide?
The IUPAC name of N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide (CID 119069345) is N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide.
What is the SMILES notation for N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide?
The canonical SMILES for N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide is CCN(Cc1ccccc1)C(=O)Cn1nccc1C1CCCNC1.
What is the InChIKey of N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide?
The InChIKey is ZKROOFWPOGMTQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-2-22(14-16-7-4-3-5-8-16)19(24)15-23-18(10-12-21-23)17-9-6-11-20-13-17/h3-5,7-8,10,12,17,20H,2,6,9,11,13-15H2,1H3.
What are the key properties of N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide?
N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide has a molecular weight of 326.44 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide is sourced from PubChem (CID 119069345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).