N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride

C14H21ClF2N2O — CID 119641466

IUPACN-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride
SMILESCCC(N)(CC)CNC(=O)C(F)(F)c1ccccc1.Cl
InChIInChI=1S/C14H20F2N2O.ClH/c1-3-13(17,4-2)10-18-12(19)14(15,16)11-8-6-5-7-9-11;/h5-9H,3-4,10,17H2,1-2H3,(H,18,19);1H
InChIKeyHLULXNGLRMHEGL-UHFFFAOYSA-N
MW306.78 g/mol
LogP2.83
Rot. Bonds6

About N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride

N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride (PubChem CID 119641466) has the molecular formula C14H21ClF2N2O and a molecular weight of 306.78 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride
PubChem CID119641466
Molecular FormulaC14H21ClF2N2O
Molecular Weight306.78 g/mol
Exact Mass306.13
IUPAC NameN-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride
SMILESCCC(N)(CC)CNC(=O)C(F)(F)c1ccccc1.Cl
InChIInChI=1S/C14H20F2N2O.ClH/c1-3-13(17,4-2)10-18-12(19)14(15,16)11-8-6-5-7-9-11;/h5-9H,3-4,10,17H2,1-2H3,(H,18,19);1H
InChIKeyHLULXNGLRMHEGL-UHFFFAOYSA-N
XLogP2.83
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.78
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-methylpropyl)-2-ethyl-2-phenylbutanamide;hydrochloride
CID 119627567
2-amino-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide;hydrochloride
CID 120588942
methyl 3-[(2,2-difluoro-2-phenylacetyl)amino]-2-hydroxy-2-methylpropanoate
CID 167942716
2,2-difluoro-N-(2-methylpropyl)-2-phenylacetamide
CID 134954879
N-(3-aminobutyl)-2,2-difluoro-2-phenylacetamide
CID 119496872
3-[(2,2-difluoro-2-phenylacetyl)amino]-2-methylpropanoic acid
CID 119237323
N-(2-amino-2-ethylbutyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 119640750
N-(2-amino-2-ethylbutyl)-2-fluoro-5-(trifluoromethyl)benzamide;hydrochloride
CID 119643636
N-(2-amino-2-ethylbutyl)-2-benzoylbenzamide;hydrochloride
CID 119639602
N-butan-2-yl-2,2-difluoro-2-phenylacetamide
CID 164554338
N-(2-amino-2-ethylbutyl)-3-phenylpentanamide;hydrochloride
CID 119643360
ethane;N-ethyl-2,2-difluoro-2-phenylacetamide;2-fluoro-2-phenylacetamide;molecular hydrogen
CID 165408243

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride?
The IUPAC name of N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride (CID 119641466) is N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride is CCC(N)(CC)CNC(=O)C(F)(F)c1ccccc1.Cl.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride?
The InChIKey is HLULXNGLRMHEGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N2O.ClH/c1-3-13(17,4-2)10-18-12(19)14(15,16)11-8-6-5-7-9-11;/h5-9H,3-4,10,17H2,1-2H3,(H,18,19);1H.
What are the key properties of N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride?
N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride has a molecular weight of 306.78 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-2,2-difluoro-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 119641466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).