2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide

C10H17F3N2O2 — CID 55063758

IUPAC2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CNC1CCCCC1O)NCC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)6-15-9(17)5-14-7-3-1-2-4-8(7)16/h7-8,14,16H,1-6H2,(H,15,17)
InChIKeyZGLJQMUDECYWHJ-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.56
Rot. Bonds4

About 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide

2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 55063758) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID55063758
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CNC1CCCCC1O)NCC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)6-15-9(17)5-14-7-3-1-2-4-8(7)16/h7-8,14,16H,1-6H2,(H,15,17)
InChIKeyZGLJQMUDECYWHJ-UHFFFAOYSA-N
XLogP0.56
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-N'-[(1S,2S)-2-hydroxycyclohexyl]oxamide
CID 136581114
N-[(1R,2R)-2-hydroxycyclohexyl]-2-[methyl(propan-2-yl)amino]acetamide
CID 137986908
2-amino-N-(4-hydroxycyclohexyl)acetamide
CID 14798998
trans-(1R,6R)-2,2-difluoro-6-hydroxy-N-(2,2,2-trifluoroacetyl)cyclohexan-1-amine oxide
CID 163731205
2,2,3,3,4,4,4-heptafluoro-N-(2-hydroxycyclohexyl)butanamide
CID 3731946
N-(4-hydroxycyclohexyl)-2-(methylamino)acetamide
CID 24692983
2,2,3,3,4,4,4-heptafluoro-N-[(1R,2S)-2-hydroxycyclohexyl]butanamide
CID 40538954
2,2,3,3,4,4,4-heptafluoro-N-[(1S,2S)-2-hydroxycyclohexyl]butanamide
CID 40538958
2,2,3,3,4,4,4-heptafluoro-N-[(1R,2R)-2-hydroxycyclohexyl]butanamide
CID 40538963
2,2,3,3,4,4,4-heptafluoro-N-[(1S,2R)-2-hydroxycyclohexyl]butanamide
CID 40538968
2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 60684895
2-[cyclohexyl(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 60694284

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide (CID 55063758) is 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide is O=C(CNC1CCCCC1O)NCC(F)(F)F.
What is the InChIKey of 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is ZGLJQMUDECYWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c11-10(12,13)6-15-9(17)5-14-7-3-1-2-4-8(7)16/h7-8,14,16H,1-6H2,(H,15,17).
What are the key properties of 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 254.25 g/mol, XLogP of 0.56, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxycyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 55063758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).