N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide

C16H23ClN2O — CID 581073

IUPACN-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide
SMILESCC1CC(C)CN(CCC(=O)Nc2cccc(Cl)c2)C1
InChIInChI=1S/C16H23ClN2O/c1-12-8-13(2)11-19(10-12)7-6-16(20)18-15-5-3-4-14(17)9-15/h3-5,9,12-13H,6-8,10-11H2,1-2H3,(H,18,20)
InChIKeyZNGZMOAFFPQHLK-UHFFFAOYSA-N
MW294.83 g/mol
LogP3.65
Rot. Bonds4

About N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide

N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide (PubChem CID 581073) has the molecular formula C16H23ClN2O and a molecular weight of 294.83 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide
PubChem CID581073
Molecular FormulaC16H23ClN2O
Molecular Weight294.83 g/mol
Exact Mass294.15
IUPAC NameN-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide
SMILESCC1CC(C)CN(CCC(=O)Nc2cccc(Cl)c2)C1
InChIInChI=1S/C16H23ClN2O/c1-12-8-13(2)11-19(10-12)7-6-16(20)18-15-5-3-4-14(17)9-15/h3-5,9,12-13H,6-8,10-11H2,1-2H3,(H,18,20)
InChIKeyZNGZMOAFFPQHLK-UHFFFAOYSA-N
XLogP3.65
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.83
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide?
The IUPAC name of N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide (CID 581073) is N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide?
The canonical SMILES for N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide is CC1CC(C)CN(CCC(=O)Nc2cccc(Cl)c2)C1.
What is the InChIKey of N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide?
The InChIKey is ZNGZMOAFFPQHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O/c1-12-8-13(2)11-19(10-12)7-6-16(20)18-15-5-3-4-14(17)9-15/h3-5,9,12-13H,6-8,10-11H2,1-2H3,(H,18,20).
What are the key properties of N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide?
N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide has a molecular weight of 294.83 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide is sourced from PubChem (CID 581073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).