N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide

C14H23F3N2O2 — CID 86817721

IUPACN-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(C(F)(F)F)CC1)NC1CCC(O)CC1
InChIInChI=1S/C14H23F3N2O2/c15-14(16,17)10-5-7-19(8-6-10)9-13(21)18-11-1-3-12(20)4-2-11/h10-12,20H,1-9H2,(H,18,21)
InChIKeyOTTDAVAOXVBQRD-UHFFFAOYSA-N
MW308.34 g/mol
LogP1.68
Rot. Bonds3

About N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide

N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide (PubChem CID 86817721) has the molecular formula C14H23F3N2O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide
PubChem CID86817721
Molecular FormulaC14H23F3N2O2
Molecular Weight308.34 g/mol
Exact Mass308.17
IUPAC NameN-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(C(F)(F)F)CC1)NC1CCC(O)CC1
InChIInChI=1S/C14H23F3N2O2/c15-14(16,17)10-5-7-19(8-6-10)9-13(21)18-11-1-3-12(20)4-2-11/h10-12,20H,1-9H2,(H,18,21)
InChIKeyOTTDAVAOXVBQRD-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-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-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

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide (CID 86817721) is N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide is O=C(CN1CCC(C(F)(F)F)CC1)NC1CCC(O)CC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide?
The InChIKey is OTTDAVAOXVBQRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O2/c15-14(16,17)10-5-7-19(8-6-10)9-13(21)18-11-1-3-12(20)4-2-11/h10-12,20H,1-9H2,(H,18,21).
What are the key properties of N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide?
N-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide 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-(4-hydroxycyclohexyl)-2-[4-(trifluoromethyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 86817721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).