N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide

C11H19F3N2O — CID 50968311

IUPACN-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide
SMILESCNC(=O)CC1CCN(CCC(F)(F)F)CC1
InChIInChI=1S/C11H19F3N2O/c1-15-10(17)8-9-2-5-16(6-3-9)7-4-11(12,13)14/h9H,2-8H2,1H3,(H,15,17)
InChIKeyKWLNGZIAMCOEAU-UHFFFAOYSA-N
MW252.28 g/mol
LogP1.79
Rot. Bonds4

About N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide

N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide (PubChem CID 50968311) has the molecular formula C11H19F3N2O and a molecular weight of 252.28 g/mol. Its IUPAC name is N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide
PubChem CID50968311
Molecular FormulaC11H19F3N2O
Molecular Weight252.28 g/mol
Exact Mass252.14
IUPAC NameN-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide
SMILESCNC(=O)CC1CCN(CCC(F)(F)F)CC1
InChIInChI=1S/C11H19F3N2O/c1-15-10(17)8-9-2-5-16(6-3-9)7-4-11(12,13)14/h9H,2-8H2,1H3,(H,15,17)
InChIKeyKWLNGZIAMCOEAU-UHFFFAOYSA-N
XLogP1.79
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N,N-Diethyl-4-piperidinecarboxamide
CID 410920
N,N-dimethylpiperidine-4-carboxamide
CID 411689
N,N-dimethylpiperidine-4-carboxamide hydrochloride
CID 19872414
N-methyl-2-(piperidin-4-yl)acetamide
CID 20569899
5-(Trifluoromethyl)piperidin-2-one
CID 16228088
N,N-Dimethyl-3-(piperidin-4-yl)propanamide
CID 20569934
N-(2,2,2-trifluoroethyl)piperidine-4-carboxamide hydrochloride
CID 42933701
3-(Trifluoromethyl)piperidin-2-one
CID 42944935
N,N-Dimethyl-2-(piperidin-4-yl)acetamide--hydrogen chloride (1/1)
CID 54759134
2-Piperidinone, 4-(trifluoromethyl)-
CID 77520161
2,2,2-Trifluoro-N-(piperidin-4-ylmethyl)acetamide
CID 17998885
N-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 16228133

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide?
The IUPAC name of N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide (CID 50968311) is N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide is CNC(=O)CC1CCN(CCC(F)(F)F)CC1.
What is the InChIKey of N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide?
The InChIKey is KWLNGZIAMCOEAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O/c1-15-10(17)8-9-2-5-16(6-3-9)7-4-11(12,13)14/h9H,2-8H2,1H3,(H,15,17).
What are the key properties of N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide?
N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide has a molecular weight of 252.28 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-(3,3,3-trifluoropropyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 50968311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).