2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide

C10H17F3N2O2 — CID 43698417

IUPAC2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide
SMILESNCC(=O)NC1CCCC(OCC(F)(F)F)C1
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)6-17-8-3-1-2-7(4-8)15-9(16)5-14/h7-8H,1-6,14H2,(H,15,16)
InChIKeyGXDNGOBOQAGKFY-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.95
Rot. Bonds4

About 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide

2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide (PubChem CID 43698417) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide
PubChem CID43698417
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide
SMILESNCC(=O)NC1CCCC(OCC(F)(F)F)C1
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)6-17-8-3-1-2-7(4-8)15-9(16)5-14/h7-8H,1-6,14H2,(H,15,16)
InChIKeyGXDNGOBOQAGKFY-UHFFFAOYSA-N
XLogP0.95
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]pyrrolidine-2-carboxamide
CID 43698410
(2S)-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]pyrrolidine-2-carboxamide
CID 61155301
(2S)-1-methyl-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]pyrrolidine-2-carboxamide
CID 90063146
(2S)-1-iodo-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]azetidine-2-carboxamide
CID 90063155
N-[3-(3-fluorocyclohexyl)oxycyclohexyl]acetamide
CID 134388649
N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]piperidine-2-carboxamide
CID 43698414
2-amino-3-methyl-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]butanamide
CID 43698418
6-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]hexanamide
CID 43698419
3-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]propanamide
CID 43698422
2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]propanamide
CID 43698425
2-amino-3-methyl-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]pentanamide
CID 43698430
4-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]butanamide
CID 43698431

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide?
The IUPAC name of 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide (CID 43698417) is 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide.
What is the SMILES notation for 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide?
The canonical SMILES for 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide is NCC(=O)NC1CCCC(OCC(F)(F)F)C1.
What is the InChIKey of 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide?
The InChIKey is GXDNGOBOQAGKFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c11-10(12,13)6-17-8-3-1-2-7(4-8)15-9(16)5-14/h7-8H,1-6,14H2,(H,15,16).
What are the key properties of 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide?
2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide has a molecular weight of 254.25 g/mol, XLogP of 0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]acetamide is sourced from PubChem (CID 43698417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).