N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine

C7H15F2N — CID 126663851

IUPACN-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)CC(F)F
InChIInChI=1S/C7H15F2N/c1-6(2)4-10(3)5-7(8)9/h6-7H,4-5H2,1-3H3
InChIKeyIRVOCFJUHLECNK-UHFFFAOYSA-N
MW151.20 g/mol
LogP1.84
Rot. Bonds4

About N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine

N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine (PubChem CID 126663851) has the molecular formula C7H15F2N and a molecular weight of 151.20 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine
PubChem CID126663851
Molecular FormulaC7H15F2N
Molecular Weight151.20 g/mol
Exact Mass151.12
IUPAC NameN-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)CC(F)F
InChIInChI=1S/C7H15F2N/c1-6(2)4-10(3)5-7(8)9/h6-7H,4-5H2,1-3H3
InChIKeyIRVOCFJUHLECNK-UHFFFAOYSA-N
XLogP1.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.20
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine
CID 177032219
3-[2,2-difluoroethyl(methyl)amino]propane-1,2-diol
CID 115773225
N'-(2,2-difluoroethyl)-N,N,N'-trimethylethane-1,2-diamine
CID 155737980
ethane;N-ethyl-N,2-dimethylpropan-1-amine
CID 143400672
4-fluoro-N-methyl-N-(2-methylpropyl)butan-1-amine
CID 126593992
2,2-difluoro-N-methyl-N-oxidoethanamine
CID 126664092
2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol
CID 115250601
1-[2,2-difluoroethyl(methyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106992238
3,3,3-trifluoro-2-[[methyl(2-methylpropyl)amino]methyl]propanoic acid
CID 80996963
3-amino-4-[methyl(2-methylpropyl)amino]butan-1-ol
CID 64900718
3-[2,2-difluoroethyl(methyl)amino]propanethioamide
CID 60923206
2-N-ethyl-1-N-methyl-1-N-(2-methylpropyl)butane-1,2-diamine
CID 62040549

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine?
The IUPAC name of N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine (CID 126663851) is N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine.
What is the SMILES notation for N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine?
The canonical SMILES for N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine is CC(C)CN(C)CC(F)F.
What is the InChIKey of N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine?
The InChIKey is IRVOCFJUHLECNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15F2N/c1-6(2)4-10(3)5-7(8)9/h6-7H,4-5H2,1-3H3.
What are the key properties of N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine?
N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine has a molecular weight of 151.20 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 126663851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).