2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide

C15H18Cl2N2O2 — CID 2128346

IUPAC2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
SMILESCC1CCN(CC1)C(=O)CNC(=O)C2=C(C=C(C=C2)Cl)Cl
InChIInChI=1S/C15H18Cl2N2O2/c1-10-4-6-19(7-5-10)14(20)9-18-15(21)12-3-2-11(16)8-13(12)17/h2-3,8,10H,4-7,9H2,1H3,(H,18,21)
InChIKeyCZYFBBPWDPPXPV-UHFFFAOYSA-N
MW329.20 g/mol
LogP3.30
Rot. Bonds3

About 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide

2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide (PubChem CID 2128346) has the molecular formula C15H18Cl2N2O2 and a molecular weight of 329.20 g/mol. Its IUPAC name is 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
PubChem CID2128346
Molecular FormulaC15H18Cl2N2O2
Molecular Weight329.20 g/mol
Exact Mass328.07
IUPAC Name2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
SMILESCC1CCN(CC1)C(=O)CNC(=O)C2=C(C=C(C=C2)Cl)Cl
InChIInChI=1S/C15H18Cl2N2O2/c1-10-4-6-19(7-5-10)14(20)9-18-15(21)12-3-2-11(16)8-13(12)17/h2-3,8,10H,4-7,9H2,1H3,(H,18,21)
InChIKeyCZYFBBPWDPPXPV-UHFFFAOYSA-N
XLogP3.30
TPSA49.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity384

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.20
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 4235
Ixazomib
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Z944
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1-(3-Chlorobenzoyl)piperazine
CID 1074765
1-(2-Chloro-benzoyl)-piperazine
CID 2060585
2,6-Dichloro-N-[1-(1-methylethyl)-4-piperidinyl]benzamide
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Benzamide derivative 11
CID 41306362
N-(2-amino-2-oxoethyl)-4-chlorobenzamide
CID 350021
1-(4-Chlorobenzoyl)-4-methylpiperazine
CID 792974
4-chloro-N-[1-(2,6-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]benzenecarboxamide
CID 3554910

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide (CID 2128346) is 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide is CC1CCN(CC1)C(=O)CNC(=O)C2=C(C=C(C=C2)Cl)Cl.
What is the InChIKey of 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The InChIKey is CZYFBBPWDPPXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18Cl2N2O2/c1-10-4-6-19(7-5-10)14(20)9-18-15(21)12-3-2-11(16)8-13(12)17/h2-3,8,10H,4-7,9H2,1H3,(H,18,21).
What are the key properties of 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide has a molecular weight of 329.20 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide is sourced from PubChem (CID 2128346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).