N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide

C14H25F3N2O2 — CID 78903328

IUPACN-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)COC1CCN(CC(=O)N(C)CC(F)(F)F)CC1
InChIInChI=1S/C14H25F3N2O2/c1-11(2)9-21-12-4-6-19(7-5-12)8-13(20)18(3)10-14(15,16)17/h11-12H,4-10H2,1-3H3
InChIKeyBPMMTVFYXXZCJY-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.14
Rot. Bonds6

About N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide

N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 78903328) has the molecular formula C14H25F3N2O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID78903328
Molecular FormulaC14H25F3N2O2
Molecular Weight310.36 g/mol
Exact Mass310.19
IUPAC NameN-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)COC1CCN(CC(=O)N(C)CC(F)(F)F)CC1
InChIInChI=1S/C14H25F3N2O2/c1-11(2)9-21-12-4-6-19(7-5-12)8-13(20)18(3)10-14(15,16)17/h11-12H,4-10H2,1-3H3
InChIKeyBPMMTVFYXXZCJY-UHFFFAOYSA-N
XLogP2.14
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide (CID 78903328) is N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide is CC(C)COC1CCN(CC(=O)N(C)CC(F)(F)F)CC1.
What is the InChIKey of N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is BPMMTVFYXXZCJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O2/c1-11(2)9-21-12-4-6-19(7-5-12)8-13(20)18(3)10-14(15,16)17/h11-12H,4-10H2,1-3H3.
What are the key properties of N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide?
N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 310.36 g/mol, XLogP of 2.14, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-(2-methylpropoxy)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 78903328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).