2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide

C17H22Cl2N2O4 — CID 108567011

IUPAC2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide
SMILESCOCCOCC(=O)N1CCC(NC(=O)c2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C17H22Cl2N2O4/c1-24-8-9-25-11-16(22)21-6-4-13(5-7-21)20-17(23)14-3-2-12(18)10-15(14)19/h2-3,10,13H,4-9,11H2,1H3,(H,20,23)
InChIKeyCVLVKTZIXLNDJQ-UHFFFAOYSA-N
MW389.28 g/mol
LogP2.38
Rot. Bonds7

About 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide

2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide (PubChem CID 108567011) has the molecular formula C17H22Cl2N2O4 and a molecular weight of 389.28 g/mol. Its IUPAC name is 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide
PubChem CID108567011
Molecular FormulaC17H22Cl2N2O4
Molecular Weight389.28 g/mol
Exact Mass388.10
IUPAC Name2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide
SMILESCOCCOCC(=O)N1CCC(NC(=O)c2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C17H22Cl2N2O4/c1-24-8-9-25-11-16(22)21-6-4-13(5-7-21)20-17(23)14-3-2-12(18)10-15(14)19/h2-3,10,13H,4-9,11H2,1H3,(H,20,23)
InChIKeyCVLVKTZIXLNDJQ-UHFFFAOYSA-N
XLogP2.38
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.28
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-chloro-2-methoxy-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide
CID 108552287
1-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-2-(2-methoxyethoxy)ethanone
CID 108570061
2,4-dichloro-N-[1-[3-(4-methylphenyl)propanoyl]piperidin-4-yl]benzamide
CID 108566500
2,4-dichloro-N-(1-ethylpiperidin-4-yl)benzamide
CID 17174058
N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]-4-methylbenzamide
CID 108549152
2,5-dichloro-N-[1-(2-chloroacetyl)piperidin-4-yl]benzamide
CID 108561589
2,5-dichloro-N-[1-(3-chloropropanoyl)piperidin-4-yl]benzamide
CID 108561573
methyl 4-[(2,5-dichlorobenzoyl)amino]piperidine-1-carboxylate
CID 108561576
N-[1-[2-(2,4-dichlorophenoxy)acetyl]piperidin-4-yl]-2-hydroxybenzamide
CID 108551390
N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]cyclopropanecarboxamide
CID 108555122
4-ethoxy-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide
CID 108551932
2,5-dichloro-N-[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]benzamide
CID 108554575

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide?
The IUPAC name of 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide (CID 108567011) is 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide is COCCOCC(=O)N1CCC(NC(=O)c2ccc(Cl)cc2Cl)CC1.
What is the InChIKey of 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide?
The InChIKey is CVLVKTZIXLNDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22Cl2N2O4/c1-24-8-9-25-11-16(22)21-6-4-13(5-7-21)20-17(23)14-3-2-12(18)10-15(14)19/h2-3,10,13H,4-9,11H2,1H3,(H,20,23).
What are the key properties of 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide?
2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide has a molecular weight of 389.28 g/mol, XLogP of 2.38, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[1-[2-(2-methoxyethoxy)acetyl]piperidin-4-yl]benzamide is sourced from PubChem (CID 108567011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).