N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride

C7H13ClF4N2O — CID 119627588

IUPACN-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
SMILESCC(C)(N)CNC(=O)C(F)(F)C(F)F.Cl
InChIInChI=1S/C7H12F4N2O.ClH/c1-6(2,12)3-13-5(14)7(10,11)4(8)9;/h4H,3,12H2,1-2H3,(H,13,14);1H
InChIKeyVRKVEMVTGMGGNI-UHFFFAOYSA-N
MW252.64 g/mol
LogP1.16
Rot. Bonds4

About N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride

N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride (PubChem CID 119627588) has the molecular formula C7H13ClF4N2O and a molecular weight of 252.64 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
PubChem CID119627588
Molecular FormulaC7H13ClF4N2O
Molecular Weight252.64 g/mol
Exact Mass252.07
IUPAC NameN-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
SMILESCC(C)(N)CNC(=O)C(F)(F)C(F)F.Cl
InChIInChI=1S/C7H12F4N2O.ClH/c1-6(2,12)3-13-5(14)7(10,11)4(8)9;/h4H,3,12H2,1-2H3,(H,13,14);1H
InChIKeyVRKVEMVTGMGGNI-UHFFFAOYSA-N
XLogP1.16
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.64
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide
CID 113250804
methyl 2-hydroxy-3-(2,2,3,3-tetrafluoropropanoylamino)propanoate
CID 103958229
2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide
CID 106291936
2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide
CID 103734095
N-[2-(dimethylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide
CID 103732179
N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetrafluoropropanamide
CID 103770162
2,2,3,3-tetrafluoro-N-(4-hydroxybutyl)propanamide
CID 107168274
2,2,3,3-tetrafluoro-N-[(4-methylphenyl)methyl]propanamide
CID 103731962
N-(2-amino-2-methylpropyl)-2-methylcyclopropane-1-carboxamide
CID 81483791
N-(1-amino-2-cyclopropylpropan-2-yl)-2,2,3,3-tetrafluoropropanamide
CID 103806938
2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
CID 103737118
N-(2-amino-2-methylpropyl)-3-methylcyclobutane-1-carboxamide
CID 130652190

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride?
The IUPAC name of N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride (CID 119627588) is N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride is CC(C)(N)CNC(=O)C(F)(F)C(F)F.Cl.
What is the InChIKey of N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride?
The InChIKey is VRKVEMVTGMGGNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F4N2O.ClH/c1-6(2,12)3-13-5(14)7(10,11)4(8)9;/h4H,3,12H2,1-2H3,(H,13,14);1H.
What are the key properties of N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride?
N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride has a molecular weight of 252.64 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride is sourced from PubChem (CID 119627588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).