3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride

C19H24ClN3O2 — CID 120740205

IUPAC3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride
SMILESCCc1ccc(C2CNCCN2C(=O)c2cccn(C)c2=O)cc1.Cl
InChIInChI=1S/C19H23N3O2.ClH/c1-3-14-6-8-15(9-7-14)17-13-20-10-12-22(17)19(24)16-5-4-11-21(2)18(16)23;/h4-9,11,17,20H,3,10,12-13H2,1-2H3;1H
InChIKeyUGXCOFGVVLRTAF-UHFFFAOYSA-N
MW361.87 g/mol
LogP2.16
Rot. Bonds3

About 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride

3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride (PubChem CID 120740205) has the molecular formula C19H24ClN3O2 and a molecular weight of 361.87 g/mol. Its IUPAC name is 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride.

Molecular Properties

Compound Name3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride
PubChem CID120740205
Molecular FormulaC19H24ClN3O2
Molecular Weight361.87 g/mol
Exact Mass361.16
IUPAC Name3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride
SMILESCCc1ccc(C2CNCCN2C(=O)c2cccn(C)c2=O)cc1.Cl
InChIInChI=1S/C19H23N3O2.ClH/c1-3-14-6-8-15(9-7-14)17-13-20-10-12-22(17)19(24)16-5-4-11-21(2)18(16)23;/h4-9,11,17,20H,3,10,12-13H2,1-2H3;1H
InChIKeyUGXCOFGVVLRTAF-UHFFFAOYSA-N
XLogP2.16
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.87
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-(2-pyridin-3-ylpiperazine-1-carbonyl)pyridin-2-one;hydrochloride
CID 120729468
1-methyl-3-(2-pyridin-3-ylpiperazine-1-carbonyl)pyridin-2-one
CID 120729469
3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one
CID 120740709
5-[2-(4-ethylphenyl)piperazine-1-carbonyl]-2-methyl-1H-pyridin-4-one
CID 120741559
1,3-benzodioxol-4-yl-[2-(4-ethylphenyl)piperazin-1-yl]methanone
CID 120740907
3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-(furan-2-yl)-1H-pyridin-2-one;hydrochloride
CID 120741124
4-[2-(4-ethylphenyl)piperazine-1-carbonyl]benzamide;hydrochloride
CID 120740508
[2-(4-ethylphenyl)piperazin-1-yl]-(1-methylpyrazol-4-yl)methanone;hydrochloride
CID 120741506
(3-chloro-4-pyridinyl)-[2-(4-ethylphenyl)piperazin-1-yl]methanone;dihydrochloride
CID 120740616
[2-(4-ethylphenyl)piperazin-1-yl]-thiophen-3-ylmethanone;hydrochloride
CID 120740518
[2-(4-ethylphenyl)piperazin-1-yl]-(5-methylsulfanylfuran-2-yl)methanone;hydrochloride
CID 120741554
2-[3-[2-(4-ethylphenyl)piperazin-1-yl]-3-oxopropyl]isoindole-1,3-dione
CID 120741479

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride?
The IUPAC name of 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride (CID 120740205) is 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride.
What is the SMILES notation for 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride?
The canonical SMILES for 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride is CCc1ccc(C2CNCCN2C(=O)c2cccn(C)c2=O)cc1.Cl.
What is the InChIKey of 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride?
The InChIKey is UGXCOFGVVLRTAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2.ClH/c1-3-14-6-8-15(9-7-14)17-13-20-10-12-22(17)19(24)16-5-4-11-21(2)18(16)23;/h4-9,11,17,20H,3,10,12-13H2,1-2H3;1H.
What are the key properties of 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride?
3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride has a molecular weight of 361.87 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride is sourced from PubChem (CID 120740205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).