N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide

C20H22Cl2N2O — CID 11143323

IUPACN-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1
InChIInChI=1S/C20H22Cl2N2O/c21-18-7-6-16(12-19(18)22)14-24-10-8-17(9-11-24)23-20(25)13-15-4-2-1-3-5-15/h1-7,12,17H,8-11,13-14H2,(H,23,25)
InChIKeyAEGJGMINJYNNOT-UHFFFAOYSA-N
MW377.31 g/mol
LogP4.32
Rot. Bonds5

About N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide

N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide (PubChem CID 11143323) has the molecular formula C20H22Cl2N2O and a molecular weight of 377.31 g/mol. Its IUPAC name is N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide
PubChem CID11143323
Molecular FormulaC20H22Cl2N2O
Molecular Weight377.31 g/mol
Exact Mass376.11
IUPAC NameN-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1
InChIInChI=1S/C20H22Cl2N2O/c21-18-7-6-16(12-19(18)22)14-24-10-8-17(9-11-24)23-20(25)13-15-4-2-1-3-5-15/h1-7,12,17H,8-11,13-14H2,(H,23,25)
InChIKeyAEGJGMINJYNNOT-UHFFFAOYSA-N
XLogP4.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.31
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide?
The IUPAC name of N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide (CID 11143323) is N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide.
What is the SMILES notation for N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide?
The canonical SMILES for N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide is O=C(Cc1ccccc1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1.
What is the InChIKey of N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide?
The InChIKey is AEGJGMINJYNNOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22Cl2N2O/c21-18-7-6-16(12-19(18)22)14-24-10-8-17(9-11-24)23-20(25)13-15-4-2-1-3-5-15/h1-7,12,17H,8-11,13-14H2,(H,23,25).
What are the key properties of N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide?
N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide has a molecular weight of 377.31 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]-2-phenylacetamide is sourced from PubChem (CID 11143323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).