N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide

C20H23ClN2O2 — CID 16554809

IUPACN-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide
SMILESCC1CCCCN1CC(=O)Nc1cc(Cl)ccc1Oc1ccccc1
InChIInChI=1S/C20H23ClN2O2/c1-15-7-5-6-12-23(15)14-20(24)22-18-13-16(21)10-11-19(18)25-17-8-3-2-4-9-17/h2-4,8-11,13,15H,5-7,12,14H2,1H3,(H,22,24)
InChIKeyYRHMYVOAPRYBSL-UHFFFAOYSA-N
MW358.87 g/mol
LogP4.95
Rot. Bonds5

About N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide

N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide (PubChem CID 16554809) has the molecular formula C20H23ClN2O2 and a molecular weight of 358.87 g/mol. Its IUPAC name is N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide
PubChem CID16554809
Molecular FormulaC20H23ClN2O2
Molecular Weight358.87 g/mol
Exact Mass358.14
IUPAC NameN-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide
SMILESCC1CCCCN1CC(=O)Nc1cc(Cl)ccc1Oc1ccccc1
InChIInChI=1S/C20H23ClN2O2/c1-15-7-5-6-12-23(15)14-20(24)22-18-13-16(21)10-11-19(18)25-17-8-3-2-4-9-17/h2-4,8-11,13,15H,5-7,12,14H2,1H3,(H,22,24)
InChIKeyYRHMYVOAPRYBSL-UHFFFAOYSA-N
XLogP4.95
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.87
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(5-chloro-2-phenoxyanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 2399286
N-(4-chloro-2-fluorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 8583329
(3R)-1-[2-(5-chloro-2-phenoxyanilino)-2-oxoethyl]piperidine-3-carboxamide
CID 9304566
N-(5-chloro-2-cyanophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 2697936
N-(2-fluorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 8583353
N-(2-methylphenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 7332900
N-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 16554820
methyl 2-[1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]piperidin-2-yl]acetate
CID 60524285
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 8583209
N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 2697996
N-(2-chloro-4-methylphenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 2412165
1-[(5-chloro-2-phenoxyphenyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 90459455

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide (CID 16554809) is N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide is CC1CCCCN1CC(=O)Nc1cc(Cl)ccc1Oc1ccccc1.
What is the InChIKey of N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide?
The InChIKey is YRHMYVOAPRYBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O2/c1-15-7-5-6-12-23(15)14-20(24)22-18-13-16(21)10-11-19(18)25-17-8-3-2-4-9-17/h2-4,8-11,13,15H,5-7,12,14H2,1H3,(H,22,24).
What are the key properties of N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide?
N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide has a molecular weight of 358.87 g/mol, XLogP of 4.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-phenoxyphenyl)-2-(2-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 16554809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).