N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide

C14H18Cl2N2O — CID 2697996

IUPACN-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
SMILESC[C@@H]1CCCCN1CC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C14H18Cl2N2O/c1-10-5-2-3-8-18(10)9-13(19)17-14-11(15)6-4-7-12(14)16/h4,6-7,10H,2-3,5,8-9H2,1H3,(H,17,19)/t10-/m1/s1
InChIKeyGRKYXIOZQLSBBO-SNVBAGLBSA-N
MW301.22 g/mol
LogP3.81
Rot. Bonds3

About N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide

N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide (PubChem CID 2697996) has the molecular formula C14H18Cl2N2O and a molecular weight of 301.22 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
PubChem CID2697996
Molecular FormulaC14H18Cl2N2O
Molecular Weight301.22 g/mol
Exact Mass300.08
IUPAC NameN-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
SMILESC[C@@H]1CCCCN1CC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C14H18Cl2N2O/c1-10-5-2-3-8-18(10)9-13(19)17-14-11(15)6-4-7-12(14)16/h4,6-7,10H,2-3,5,8-9H2,1H3,(H,17,19)/t10-/m1/s1
InChIKeyGRKYXIOZQLSBBO-SNVBAGLBSA-N
XLogP3.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.22
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dimethylphenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 6994156
N-(2-chloro-4,6-dimethylphenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 8583041
N-(2-ethyl-6-methylphenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 16554808
N-(2,6-dichlorophenyl)-2-[(2S)-2-methylpiperazin-1-yl]acetamide
CID 82713393
N-(3,4-dichlorophenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 2697918
N-(2-chloro-4-methylphenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 2412165
N-(2,6-dichlorophenyl)-2-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]acetamide
CID 102788684
N-(4-acetamidophenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 4818604
N-(3-chloro-4-fluorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 2655154
N-(2-methylphenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 7332900
N-(2-fluorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 8583353
N-(2,6-dibromo-4-methylphenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 46801135

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide (CID 2697996) is N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide is C[C@@H]1CCCCN1CC(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide?
The InChIKey is GRKYXIOZQLSBBO-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H18Cl2N2O/c1-10-5-2-3-8-18(10)9-13(19)17-14-11(15)6-4-7-12(14)16/h4,6-7,10H,2-3,5,8-9H2,1H3,(H,17,19)/t10-/m1/s1.
What are the key properties of N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide?
N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide has a molecular weight of 301.22 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide is sourced from PubChem (CID 2697996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).