4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide

C14H25F3N2O3 — CID 75443058

IUPAC4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
SMILESCOCCC(NC(=O)N1CCC(O)(C(F)(F)F)CC1)C(C)C
InChIInChI=1S/C14H25F3N2O3/c1-10(2)11(4-9-22-3)18-12(20)19-7-5-13(21,6-8-19)14(15,16)17/h10-11,21H,4-9H2,1-3H3,(H,18,20)
InChIKeyREKMEZIRHYZVCV-UHFFFAOYSA-N
MW326.36 g/mol
LogP2.15
Rot. Bonds5

About 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide

4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide (PubChem CID 75443058) has the molecular formula C14H25F3N2O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
PubChem CID75443058
Molecular FormulaC14H25F3N2O3
Molecular Weight326.36 g/mol
Exact Mass326.18
IUPAC Name4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
SMILESCOCCC(NC(=O)N1CCC(O)(C(F)(F)F)CC1)C(C)C
InChIInChI=1S/C14H25F3N2O3/c1-10(2)11(4-9-22-3)18-12(20)19-7-5-13(21,6-8-19)14(15,16)17/h10-11,21H,4-9H2,1-3H3,(H,18,20)
InChIKeyREKMEZIRHYZVCV-UHFFFAOYSA-N
XLogP2.15
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-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

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The IUPAC name of 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide (CID 75443058) is 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide is COCCC(NC(=O)N1CCC(O)(C(F)(F)F)CC1)C(C)C.
What is the InChIKey of 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The InChIKey is REKMEZIRHYZVCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O3/c1-10(2)11(4-9-22-3)18-12(20)19-7-5-13(21,6-8-19)14(15,16)17/h10-11,21H,4-9H2,1-3H3,(H,18,20).
What are the key properties of 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide has a molecular weight of 326.36 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(1-methoxy-4-methylpentan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide is sourced from PubChem (CID 75443058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).