ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen

C20H29F3N2O2 — CID 165408243

IUPACethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen
SMILESCC.CCNC(=O)C(F)(F)c1ccccc1.NC(=O)C(F)c1ccccc1.[H][H].[H][H]
InChIInChI=1S/C10H11F2NO.C8H8FNO.C2H6.2H2/c1-2-13-9(14)10(11,12)8-6-4-3-5-7-8;9-7(8(10)11)6-4-2-1-3-5-6;1-2;;/h3-7H,2H2,1H3,(H,13,14);1-5,7H,(H2,10,11);1-2H3;2*1H
InChIKeyHZLIQGMDIXGQCC-UHFFFAOYSA-N
MW386.46 g/mol
LogP4.62
Rot. Bonds5

About ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen

ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen (PubChem CID 165408243) has the molecular formula C20H29F3N2O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen.

Molecular Properties

Compound Nameethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen
PubChem CID165408243
Molecular FormulaC20H29F3N2O2
Molecular Weight386.46 g/mol
Exact Mass386.22
IUPAC Nameethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen
SMILESCC.CCNC(=O)C(F)(F)c1ccccc1.NC(=O)C(F)c1ccccc1.[H][H].[H][H]
InChIInChI=1S/C10H11F2NO.C8H8FNO.C2H6.2H2/c1-2-13-9(14)10(11,12)8-6-4-3-5-7-8;9-7(8(10)11)6-4-2-1-3-5-6;1-2;;/h3-7H,2H2,1H3,(H,13,14);1-5,7H,(H2,10,11);1-2H3;2*1H
InChIKeyHZLIQGMDIXGQCC-UHFFFAOYSA-N
XLogP4.62
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2-difluoro-N-(2-methylpropyl)-2-phenylacetamide
CID 134954879
N-(3-aminobutyl)-2,2-difluoro-2-phenylacetamide
CID 119496872
N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride
CID 119641466
3-[(2,2-difluoro-2-phenylacetyl)amino]-2-methylpropanoic acid
CID 119237323
N-ethyl-2,2-dimethyl-3-phenylbutanamide
CID 59419624
N-[2-(2,6-diamino-4-pyridinyl)-2-phenylethyl]-2,2-difluoro-2-phenylacetamide
CID 130431732
N-butan-2-yl-2,2-difluoro-2-phenylacetamide
CID 164554338
2-amino-N-ethyl-2-phenylacetamide
CID 22262703
4-amino-N-ethyl-2,3-dimethyl-2-phenylbutanamide;methanol
CID 143150724
ethane;N-ethyl-3-hydroxy-3-phenylpropanamide
CID 143411629
methyl 3-[(2,2-difluoro-2-phenylacetyl)amino]-2-hydroxy-2-methylpropanoate
CID 167942716
1-fluoro-1-phenylbutan-2-one
CID 90470836

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen?
The IUPAC name of ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen (CID 165408243) is ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen.
What is the SMILES notation for ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen?
The canonical SMILES for ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen is CC.CCNC(=O)C(F)(F)c1ccccc1.NC(=O)C(F)c1ccccc1.[H][H].[H][H].
What is the InChIKey of ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen?
The InChIKey is HZLIQGMDIXGQCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO.C8H8FNO.C2H6.2H2/c1-2-13-9(14)10(11,12)8-6-4-3-5-7-8;9-7(8(10)11)6-4-2-1-3-5-6;1-2;;/h3-7H,2H2,1H3,(H,13,14);1-5,7H,(H2,10,11);1-2H3;2*1H.
What are the key properties of ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen?
ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen has a molecular weight of 386.46 g/mol, XLogP of 4.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen is sourced from PubChem (CID 165408243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).