N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide

C14H23F3N2O2 — CID 134505544

IUPACN-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
SMILESCC(C)N1CCC(NC(=O)C2(C(F)(F)F)CCC2)C(O)C1
InChIInChI=1S/C14H23F3N2O2/c1-9(2)19-7-4-10(11(20)8-19)18-12(21)13(5-3-6-13)14(15,16)17/h9-11,20H,3-8H2,1-2H3,(H,18,21)
InChIKeyJJLKCXBLAOSYEL-UHFFFAOYSA-N
MW308.34 g/mol
LogP1.68
Rot. Bonds3

About N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide

N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide (PubChem CID 134505544) has the molecular formula C14H23F3N2O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
PubChem CID134505544
Molecular FormulaC14H23F3N2O2
Molecular Weight308.34 g/mol
Exact Mass308.17
IUPAC NameN-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
SMILESCC(C)N1CCC(NC(=O)C2(C(F)(F)F)CCC2)C(O)C1
InChIInChI=1S/C14H23F3N2O2/c1-9(2)19-7-4-10(11(20)8-19)18-12(21)13(5-3-6-13)14(15,16)17/h9-11,20H,3-8H2,1-2H3,(H,18,21)
InChIKeyJJLKCXBLAOSYEL-UHFFFAOYSA-N
XLogP1.68
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide 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-[1-[(2R)-2-hydroxybutyl]piperidin-4-yl]cyclobutanecarboxamide
CID 71989064
N-(3-hydroxy-1-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide
CID 134435218
N-(3-hydroxy-1-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
CID 134435219
3,3-difluoro-N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)cyclobutane-1-carboxamide
CID 134435308
4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide
CID 134435532
N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide
CID 134505537
4,4,4-trifluoro-N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)butanamide
CID 134505567
3-fluoro-N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylcyclobutane-1-carboxamide
CID 134505731
3,3-difluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)cyclobutane-1-carboxamide
CID 134506075
N-(1-ethyl-3-hydroxypiperidin-4-yl)-3,3-difluorocyclobutane-1-carboxamide
CID 134515026
2,2,2-trifluoro-N-[2-hydroxy-2-(1-propan-2-ylpiperidin-4-yl)ethyl]acetamide
CID 138612298
ethane;N-(3-hydroxy-1-methylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide
CID 142326840

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide?
The IUPAC name of N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide (CID 134505544) is N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide.
What is the SMILES notation for N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide?
The canonical SMILES for N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide is CC(C)N1CCC(NC(=O)C2(C(F)(F)F)CCC2)C(O)C1.
What is the InChIKey of N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide?
The InChIKey is JJLKCXBLAOSYEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O2/c1-9(2)19-7-4-10(11(20)8-19)18-12(21)13(5-3-6-13)14(15,16)17/h9-11,20H,3-8H2,1-2H3,(H,18,21).
What are the key properties of N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide?
N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 134505544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).