2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide

C23H30N2O2 — CID 154774838

IUPAC2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide
SMILESCC(C)COC1CCN(C(C(=O)Nc2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C23H30N2O2/c1-18(2)17-27-21-13-15-25(16-14-21)22(19-9-5-3-6-10-19)23(26)24-20-11-7-4-8-12-20/h3-12,18,21-22H,13-17H2,1-2H3,(H,24,26)
InChIKeyFMIYILVEWJQKQJ-UHFFFAOYSA-N
MW366.51 g/mol
LogP4.50
Rot. Bonds7

About 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide

2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide (PubChem CID 154774838) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide.

Molecular Properties

Compound Name2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide
PubChem CID154774838
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC Name2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide
SMILESCC(C)COC1CCN(C(C(=O)Nc2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C23H30N2O2/c1-18(2)17-27-21-13-15-25(16-14-21)22(19-9-5-3-6-10-19)23(26)24-20-11-7-4-8-12-20/h3-12,18,21-22H,13-17H2,1-2H3,(H,24,26)
InChIKeyFMIYILVEWJQKQJ-UHFFFAOYSA-N
XLogP4.50
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide?
The IUPAC name of 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide (CID 154774838) is 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide.
What is the SMILES notation for 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide?
The canonical SMILES for 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide is CC(C)COC1CCN(C(C(=O)Nc2ccccc2)c2ccccc2)CC1.
What is the InChIKey of 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide?
The InChIKey is FMIYILVEWJQKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-18(2)17-27-21-13-15-25(16-14-21)22(19-9-5-3-6-10-19)23(26)24-20-11-7-4-8-12-20/h3-12,18,21-22H,13-17H2,1-2H3,(H,24,26).
What are the key properties of 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide?
2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide has a molecular weight of 366.51 g/mol, XLogP of 4.50, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylpropoxy)piperidin-1-yl]-N,2-diphenylacetamide is sourced from PubChem (CID 154774838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).