N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide

C10H16F3NO3 — CID 103616648

IUPACN-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide
SMILESO=C(COCC(F)(F)F)NC1CCC(O)CC1
InChIInChI=1S/C10H16F3NO3/c11-10(12,13)6-17-5-9(16)14-7-1-3-8(15)4-2-7/h7-8,15H,1-6H2,(H,14,16)
InChIKeyHXWWSIBPYLOMBC-UHFFFAOYSA-N
MW255.24 g/mol
LogP0.99
Rot. Bonds4

About N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide

N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide (PubChem CID 103616648) has the molecular formula C10H16F3NO3 and a molecular weight of 255.24 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide
PubChem CID103616648
Molecular FormulaC10H16F3NO3
Molecular Weight255.24 g/mol
Exact Mass255.11
IUPAC NameN-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide
SMILESO=C(COCC(F)(F)F)NC1CCC(O)CC1
InChIInChI=1S/C10H16F3NO3/c11-10(12,13)6-17-5-9(16)14-7-1-3-8(15)4-2-7/h7-8,15H,1-6H2,(H,14,16)
InChIKeyHXWWSIBPYLOMBC-UHFFFAOYSA-N
XLogP0.99
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.24
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,2-Trifluoro-N-(4-hydroxycyclohexyl)acetamide
CID 59818256
2,2,2-trifluoro-N-[(4-hydroxyoxan-2-yl)methyl]acetamide
CID 144092318
3,3,3-trifluoro-N-(4-hydroxycyclohexyl)propanamide
CID 43417251
N-(4-hydroxycyclohexyl)-3-(2,2,2-trifluoroethoxy)propanamide
CID 43417397
2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide
CID 62360896
2-(4-aminocyclohexyl)oxy-N-(2,2,2-trifluoroethyl)acetamide
CID 62807944
N-[2-(4-aminocyclohexyl)oxyethyl]-3,3,3-trifluoropropanamide
CID 63870466
N-[2-(4-aminocyclohexyl)oxyethyl]-2,2,2-trifluoroacetamide
CID 63870963
4,4,4-trifluoro-N-(4-hydroxycyclohexyl)butanamide
CID 65710965
N-[2-(4-aminocyclohexyl)oxyethyl]-4,4,4-trifluorobutanamide
CID 65712577
2,2,2-trifluoro-N-[(1S,2R)-2-hydroxycyclohexyl]acetamide
CID 101378034
2-[2-(methylamino)cyclohexyl]oxy-N-(2,2,2-trifluoroethyl)acetamide
CID 102633527

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide (CID 103616648) is N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide is O=C(COCC(F)(F)F)NC1CCC(O)CC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide?
The InChIKey is HXWWSIBPYLOMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3NO3/c11-10(12,13)6-17-5-9(16)14-7-1-3-8(15)4-2-7/h7-8,15H,1-6H2,(H,14,16).
What are the key properties of N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide?
N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide has a molecular weight of 255.24 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-2-(2,2,2-trifluoroethoxy)acetamide is sourced from PubChem (CID 103616648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).