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

C12H20F3NO2 — CID 79200809

IUPAC4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
SMILESCC(O)CCC(=O)NC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C12H20F3NO2/c1-8(17)2-7-11(18)16-10-5-3-9(4-6-10)12(13,14)15/h8-10,17H,2-7H2,1H3,(H,16,18)
InChIKeyPBSWLLFNWJGRCK-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.38
Rot. Bonds4

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

4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide (PubChem CID 79200809) has the molecular formula C12H20F3NO2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
PubChem CID79200809
Molecular FormulaC12H20F3NO2
Molecular Weight267.29 g/mol
Exact Mass267.14
IUPAC Name4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
SMILESCC(O)CCC(=O)NC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C12H20F3NO2/c1-8(17)2-7-11(18)16-10-5-3-9(4-6-10)12(13,14)15/h8-10,17H,2-7H2,1H3,(H,16,18)
InChIKeyPBSWLLFNWJGRCK-UHFFFAOYSA-N
XLogP2.38
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4,4-difluoro-N-[(2S)-1-hydroxypropan-2-yl]cyclohexane-1-carboxamide
CID 81932865
4,4,4-trifluoro-N-[(1R*)-1-(trans-3-hydroxycyclobutyl)propyl]butanamide
CID 91768221
N-(2,2-difluoroethyl)-3-hydroxycyclohexane-1-carboxamide
CID 126795290
5,5,5-trifluoro-N-(4-hydroxypentyl)-3-methylpentanamide
CID 168158668
N-(4-hydroxy-2,2-dimethylpentyl)-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 71922009
5-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
CID 79199848
4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]butanamide
CID 79200722
4-hydroxy-N-[2-(trifluoromethyl)cyclohexyl]butanamide
CID 79200810
4-hydroxy-N-[2-(trifluoromethyl)cyclohexyl]pentanamide
CID 79200898
4-hydroxy-N-[3-(trifluoromethyl)cyclohexyl]butanamide
CID 79203742
4-hydroxy-N-[3-(trifluoromethyl)cyclohexyl]pentanamide
CID 79203743
N-(5-hydroxypentan-2-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 80416616

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide?
The IUPAC name of 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide (CID 79200809) is 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide.
What is the SMILES notation for 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide?
The canonical SMILES for 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide is CC(O)CCC(=O)NC1CCC(C(F)(F)F)CC1.
What is the InChIKey of 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide?
The InChIKey is PBSWLLFNWJGRCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F3NO2/c1-8(17)2-7-11(18)16-10-5-3-9(4-6-10)12(13,14)15/h8-10,17H,2-7H2,1H3,(H,16,18).
What are the key properties of 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide?
4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide has a molecular weight of 267.29 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[4-(trifluoromethyl)cyclohexyl]pentanamide is sourced from PubChem (CID 79200809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).