2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride

C20H23ClN4O2 — CID 120734547

IUPAC2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride
SMILESCOc1ccccc1C1CNCCN1C(=O)Cn1cc2ccccc2n1.Cl
InChIInChI=1S/C20H22N4O2.ClH/c1-26-19-9-5-3-7-16(19)18-12-21-10-11-24(18)20(25)14-23-13-15-6-2-4-8-17(15)22-23;/h2-9,13,18,21H,10-12,14H2,1H3;1H
InChIKeyHYVZEWWTAGFYBX-UHFFFAOYSA-N
MW386.88 g/mol
LogP2.64
Rot. Bonds4

About 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride

2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride (PubChem CID 120734547) has the molecular formula C20H23ClN4O2 and a molecular weight of 386.88 g/mol. Its IUPAC name is 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride.

Molecular Properties

Compound Name2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride
PubChem CID120734547
Molecular FormulaC20H23ClN4O2
Molecular Weight386.88 g/mol
Exact Mass386.15
IUPAC Name2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride
SMILESCOc1ccccc1C1CNCCN1C(=O)Cn1cc2ccccc2n1.Cl
InChIInChI=1S/C20H22N4O2.ClH/c1-26-19-9-5-3-7-16(19)18-12-21-10-11-24(18)20(25)14-23-13-15-6-2-4-8-17(15)22-23;/h2-9,13,18,21H,10-12,14H2,1H3;1H
InChIKeyHYVZEWWTAGFYBX-UHFFFAOYSA-N
XLogP2.64
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.88
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(2-methoxyphenyl)piperazin-1-yl]-quinolin-2-ylmethanone
CID 110109299
[(2S)-2-(2-methoxyphenyl)piperazin-1-yl]-quinolin-2-ylmethanone
CID 129349791
2-(diethylamino)-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone
CID 120733069
1-[2-(2-methoxyphenyl)piperazin-1-yl]-4-phenylbutane-1,4-dione;hydrochloride
CID 120735112
1-[2-[2-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]pyridin-2-one
CID 120733310
3-(1,3-benzoxazol-2-yl)-1-[2-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
CID 120734145
1-[2-(2-methoxyphenyl)piperazin-1-yl]-3-pyridin-4-ylpropan-1-one;dihydrochloride
CID 120733090
1-[2-(2-methoxyphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)sulfanylethanone;hydrochloride
CID 120735083
1-[2-(2-methoxyphenyl)piperazin-1-yl]-2-(1H-pyrazol-5-yl)ethanone;dihydrochloride
CID 120733408
1-[2-[2-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride
CID 120733120
3-(4-methoxyphenyl)-1-[2-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
CID 120735115
1-[2-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-2-ylpropan-1-one
CID 120734985

Frequently Asked Questions

What is the IUPAC name of 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride?
The IUPAC name of 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride (CID 120734547) is 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride.
What is the SMILES notation for 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride?
The canonical SMILES for 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride is COc1ccccc1C1CNCCN1C(=O)Cn1cc2ccccc2n1.Cl.
What is the InChIKey of 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride?
The InChIKey is HYVZEWWTAGFYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2.ClH/c1-26-19-9-5-3-7-16(19)18-12-21-10-11-24(18)20(25)14-23-13-15-6-2-4-8-17(15)22-23;/h2-9,13,18,21H,10-12,14H2,1H3;1H.
What are the key properties of 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride?
2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride has a molecular weight of 386.88 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indazol-2-yl-1-[2-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride is sourced from PubChem (CID 120734547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).