N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide

C16H23ClN2O — CID 684899

IUPACN-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide
SMILESCC[C@@H]1CCCCN1CCC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C16H23ClN2O/c1-2-15-8-3-4-10-19(15)11-9-16(20)18-14-7-5-6-13(17)12-14/h5-7,12,15H,2-4,8-11H2,1H3,(H,18,20)/t15-/m1/s1
InChIKeyPELDFWBVLFWHIS-OAHLLOKOSA-N
MW294.83 g/mol
LogP3.93
Rot. Bonds5

About N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide

N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide (PubChem CID 684899) has the molecular formula C16H23ClN2O and a molecular weight of 294.83 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide
PubChem CID684899
Molecular FormulaC16H23ClN2O
Molecular Weight294.83 g/mol
Exact Mass294.15
IUPAC NameN-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide
SMILESCC[C@@H]1CCCCN1CCC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C16H23ClN2O/c1-2-15-8-3-4-10-19(15)11-9-16(20)18-14-7-5-6-13(17)12-14/h5-7,12,15H,2-4,8-11H2,1H3,(H,18,20)/t15-/m1/s1
InChIKeyPELDFWBVLFWHIS-OAHLLOKOSA-N
XLogP3.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.83
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 116637464
N-(3-acetamidophenyl)-3-(2-ethylpiperidin-1-yl)propanamide
CID 109032765
1-(3-chlorophenyl)-3-[3-[(2S)-2-ethylpiperidin-1-yl]propyl]urea
CID 95706023
1-(3-chlorophenyl)-3-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]urea
CID 95706022
N-(3-aminophenyl)-3-(2-propylpiperidin-1-yl)propanamide
CID 83052120
N-(1,3-benzodioxol-5-yl)-3-(2-ethylpiperidin-1-yl)propanamide
CID 51302524
3-(2-ethylpiperidin-1-yl)-N-(4-methoxyphenyl)propanamide
CID 109032752
N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
CID 53313683
N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 43266229
2-[(2S)-2-ethylpiperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 129380241
N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
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2-(2-ethylpiperidin-1-yl)-N-(3-iodophenyl)acetamide
CID 47104594

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide?
The IUPAC name of N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide (CID 684899) is N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide?
The canonical SMILES for N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide is CC[C@@H]1CCCCN1CCC(=O)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide?
The InChIKey is PELDFWBVLFWHIS-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H23ClN2O/c1-2-15-8-3-4-10-19(15)11-9-16(20)18-14-7-5-6-13(17)12-14/h5-7,12,15H,2-4,8-11H2,1H3,(H,18,20)/t15-/m1/s1.
What are the key properties of N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide?
N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide has a molecular weight of 294.83 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-[(2R)-2-ethylpiperidin-1-yl]propanamide is sourced from PubChem (CID 684899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).