5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide

C12H20F3NO2 — CID 79199848

IUPAC5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
SMILESO=C(CCCCO)NC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C12H20F3NO2/c13-12(14,15)9-4-6-10(7-5-9)16-11(18)3-1-2-8-17/h9-10,17H,1-8H2,(H,16,18)
InChIKeyKEPBFIBHXAVCDH-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.39
Rot. Bonds5

About 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide

5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide (PubChem CID 79199848) has the molecular formula C12H20F3NO2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide.

Molecular Properties

Compound Name5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
PubChem CID79199848
Molecular FormulaC12H20F3NO2
Molecular Weight267.29 g/mol
Exact Mass267.14
IUPAC Name5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
SMILESO=C(CCCCO)NC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C12H20F3NO2/c13-12(14,15)9-4-6-10(7-5-9)16-11(18)3-1-2-8-17/h9-10,17H,1-8H2,(H,16,18)
InChIKeyKEPBFIBHXAVCDH-UHFFFAOYSA-N
XLogP2.39
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
CID 114014776
3-chloro-N-[4-(trifluoromethyl)cyclohexyl]propanamide
CID 43701255
N-cyclohexyl-5-hydroxypentanamide
CID 11367641
2-bromo-N-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 63679501
N,N'-dicyclopropyldecanediamide
CID 4668836
N-(1-tert-butylpiperidin-4-yl)-5-hydroxypentanamide
CID 79199518
2-(propan-2-ylamino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 60718312
N,N'-dicyclopropylbutanediamide
CID 5225156
3-(2-aminophenyl)-N-[4-(trifluoromethyl)cyclohexyl]propanamide
CID 120608522
4-[[2-[4-(trifluoromethyl)cyclohexyl]acetyl]amino]cyclohexane-1-carboxylic acid
CID 120524479
2-(1-hydroxycyclohexyl)-N-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 111331748
N-(3-ethylcyclohexyl)-5-hydroxypentanamide
CID 79210264

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide?
The IUPAC name of 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide (CID 79199848) is 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide.
What is the SMILES notation for 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide?
The canonical SMILES for 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide is O=C(CCCCO)NC1CCC(C(F)(F)F)CC1.
What is the InChIKey of 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide?
The InChIKey is KEPBFIBHXAVCDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F3NO2/c13-12(14,15)9-4-6-10(7-5-9)16-11(18)3-1-2-8-17/h9-10,17H,1-8H2,(H,16,18).
What are the key properties of 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide?
5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide has a molecular weight of 267.29 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide is sourced from PubChem (CID 79199848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).