3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide

C15H20Cl2N2O — CID 119389948

IUPAC3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
SMILESCC(Cc1ccc(Cl)cc1Cl)C(=O)NC1CCNCC1
InChIInChI=1S/C15H20Cl2N2O/c1-10(8-11-2-3-12(16)9-14(11)17)15(20)19-13-4-6-18-7-5-13/h2-3,9-10,13,18H,4-8H2,1H3,(H,19,20)
InChIKeyZCKZTFMFHPOPFL-UHFFFAOYSA-N
MW315.24 g/mol
LogP3.04
Rot. Bonds4

About 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide

3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide (PubChem CID 119389948) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
PubChem CID119389948
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC Name3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
SMILESCC(Cc1ccc(Cl)cc1Cl)C(=O)NC1CCNCC1
InChIInChI=1S/C15H20Cl2N2O/c1-10(8-11-2-3-12(16)9-14(11)17)15(20)19-13-4-6-18-7-5-13/h2-3,9-10,13,18H,4-8H2,1H3,(H,19,20)
InChIKeyZCKZTFMFHPOPFL-UHFFFAOYSA-N
XLogP3.04
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-[[3-(2,4-dichlorophenyl)-2-methylpropanoyl]amino]cyclobutyl]acetic acid
CID 166254759
N-(2-cyclopentyl-2-hydroxyethyl)-3-(2,4-dichlorophenyl)-2-methylpropanamide
CID 86970189
3-(2,4-dichlorophenyl)-2-methyl-N-[2-(methylamino)ethyl]propanamide
CID 119503882
3-(2,4-dichlorophenyl)-2-methyl-1-[4-(methylamino)piperidin-1-yl]propan-1-one
CID 119563571
N-[(2,4-dichlorophenyl)methyl]-2-methyl-N-piperidin-4-ylpropanamide
CID 11602353
N-[(2S)-1-aminopropan-2-yl]-3-(2,4-dichlorophenyl)-2-methylpropanamide;hydrochloride
CID 120506356
2,5-dichloro-N-piperidin-4-ylbenzamide
CID 43345741
N-(2-amino-2-methylpropyl)-3-(2,4-dichlorophenyl)-2-methylpropanamide;hydrochloride
CID 119630154
N-[(2S)-3-(2,4-dichlorophenyl)-1-oxo-1-(piperidin-4-ylamino)propan-2-yl]-1-[4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide
CID 162587570
N-[1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]piperidine-4-carboxamide;hydrochloride
CID 119339810
3-(2,4-dichlorophenyl)-2-methyl-1-(2-methylpiperazin-1-yl)propan-1-one
CID 119473217
N-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide;hydrochloride
CID 119263502

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide?
The IUPAC name of 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide (CID 119389948) is 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide?
The canonical SMILES for 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide is CC(Cc1ccc(Cl)cc1Cl)C(=O)NC1CCNCC1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide?
The InChIKey is ZCKZTFMFHPOPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c1-10(8-11-2-3-12(16)9-14(11)17)15(20)19-13-4-6-18-7-5-13/h2-3,9-10,13,18H,4-8H2,1H3,(H,19,20).
What are the key properties of 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide?
3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide has a molecular weight of 315.24 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide is sourced from PubChem (CID 119389948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).