2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide

C18H24Cl2N2O2 — CID 46469925

IUPAC2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide
SMILESCC(C)(C)C(=O)N1CCC(NC(=O)Cc2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C18H24Cl2N2O2/c1-18(2,3)17(24)22-8-6-14(7-9-22)21-16(23)10-12-4-5-13(19)11-15(12)20/h4-5,11,14H,6-10H2,1-3H3,(H,21,23)
InChIKeyRLEKWYSWBCIKQG-UHFFFAOYSA-N
MW371.31 g/mol
LogP3.69
Rot. Bonds3

About 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide

2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide (PubChem CID 46469925) has the molecular formula C18H24Cl2N2O2 and a molecular weight of 371.31 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide
PubChem CID46469925
Molecular FormulaC18H24Cl2N2O2
Molecular Weight371.31 g/mol
Exact Mass370.12
IUPAC Name2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide
SMILESCC(C)(C)C(=O)N1CCC(NC(=O)Cc2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C18H24Cl2N2O2/c1-18(2,3)17(24)22-8-6-14(7-9-22)21-16(23)10-12-4-5-13(19)11-15(12)20/h4-5,11,14H,6-10H2,1-3H3,(H,21,23)
InChIKeyRLEKWYSWBCIKQG-UHFFFAOYSA-N
XLogP3.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.31
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide (CID 46469925) is 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide is CC(C)(C)C(=O)N1CCC(NC(=O)Cc2ccc(Cl)cc2Cl)CC1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide?
The InChIKey is RLEKWYSWBCIKQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24Cl2N2O2/c1-18(2,3)17(24)22-8-6-14(7-9-22)21-16(23)10-12-4-5-13(19)11-15(12)20/h4-5,11,14H,6-10H2,1-3H3,(H,21,23).
What are the key properties of 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide?
2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide has a molecular weight of 371.31 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 46469925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).