4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide

C15H20ClN3O2 — CID 63644286

IUPAC4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide
SMILESCN(CC(=O)NC(=O)c1ccc(Cl)cc1)C1CCCNC1
InChIInChI=1S/C15H20ClN3O2/c1-19(13-3-2-8-17-9-13)10-14(20)18-15(21)11-4-6-12(16)7-5-11/h4-7,13,17H,2-3,8-10H2,1H3,(H,18,20,21)
InChIKeyUJJVASFDFSWMHQ-UHFFFAOYSA-N
MW309.80 g/mol
LogP1.28
Rot. Bonds4

About 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide

4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide (PubChem CID 63644286) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide
PubChem CID63644286
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC Name4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide
SMILESCN(CC(=O)NC(=O)c1ccc(Cl)cc1)C1CCCNC1
InChIInChI=1S/C15H20ClN3O2/c1-19(13-3-2-8-17-9-13)10-14(20)18-15(21)11-4-6-12(16)7-5-11/h4-7,13,17H,2-3,8-10H2,1H3,(H,18,20,21)
InChIKeyUJJVASFDFSWMHQ-UHFFFAOYSA-N
XLogP1.28
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-4-fluorophenyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63643377
N-cyclohexyl-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63644075
N-(3-chloro-4-methylphenyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63642155
N-[2-(3-chlorophenyl)ethyl]-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63641962
N-(4-chlorophenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
CID 63638006
3-(4-chlorophenyl)-1-methyl-1-piperidin-3-ylurea
CID 63643002
N-(3-methylbutylcarbamoyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63644254
N-[2-[methyl(piperidin-3-yl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 63643556
N-(4-methylcyclohexyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 55249118
N-[2-[azetidin-3-yl(methyl)amino]acetyl]-2-chlorobenzamide
CID 66187394
1-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]ethanone
CID 43219367
N-(3-methylbutyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 55248733

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide?
The IUPAC name of 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide (CID 63644286) is 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide.
What is the SMILES notation for 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide?
The canonical SMILES for 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide is CN(CC(=O)NC(=O)c1ccc(Cl)cc1)C1CCCNC1.
What is the InChIKey of 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide?
The InChIKey is UJJVASFDFSWMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O2/c1-19(13-3-2-8-17-9-13)10-14(20)18-15(21)11-4-6-12(16)7-5-11/h4-7,13,17H,2-3,8-10H2,1H3,(H,18,20,21).
What are the key properties of 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide?
4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide has a molecular weight of 309.80 g/mol, XLogP of 1.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-[methyl(piperidin-3-yl)amino]acetyl]benzamide is sourced from PubChem (CID 63644286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).