2,3,3-trifluoro-2-methylpropan-1-amine

C4H8F3N — CID 112565083

IUPAC2,3,3-trifluoro-2-methylpropan-1-amine
SMILESCC(F)(CN)C(F)F
InChIInChI=1S/C4H8F3N/c1-4(7,2-8)3(5)6/h3H,2,8H2,1H3
InChIKeySZVPFCBITFASKT-UHFFFAOYSA-N
MW127.11 g/mol
LogP0.94
Rot. Bonds2

About 2,3,3-trifluoro-2-methylpropan-1-amine

2,3,3-trifluoro-2-methylpropan-1-amine (PubChem CID 112565083) has the molecular formula C4H8F3N and a molecular weight of 127.11 g/mol. Its IUPAC name is 2,3,3-trifluoro-2-methylpropan-1-amine.

Molecular Properties

Compound Name2,3,3-trifluoro-2-methylpropan-1-amine
PubChem CID112565083
Molecular FormulaC4H8F3N
Molecular Weight127.11 g/mol
Exact Mass127.06
IUPAC Name2,3,3-trifluoro-2-methylpropan-1-amine
SMILESCC(F)(CN)C(F)F
InChIInChI=1S/C4H8F3N/c1-4(7,2-8)3(5)6/h3H,2,8H2,1H3
InChIKeySZVPFCBITFASKT-UHFFFAOYSA-N
XLogP0.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.11
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-fluoro-2,3-dimethylhexan-1-amine
CID 107889779
ethane;2-fluoro-2-methylpropan-1-amine
CID 166112006
1-amino-2,2-difluoro-4,4-dimethylpentan-3-ol
CID 105433378
2-methyl-2-(trifluoromethyl)propane-1,3-diamine;platinum
CID 88506068
2-(difluoromethoxy)-2-methylbutan-1-amine
CID 65053075
3-fluoro-2,2-dimethylpentan-1-amine
CID 105427765
2,3,3-trifluoro-2-methylpropanamide
CID 139700951
3,3-difluoro-2,2,4-trimethylpentan-1-amine
CID 116839608
2,2-difluoro-3-methylbutan-1-amine
CID 22002026
1,1,1-trifluoroethane;1,1,2-trifluoroethane
CID 157050419
2-(aminomethyl)-2-tert-butylpropane-1,3-diamine
CID 166857268
3,3-difluoro-2-methylbutan-1-amine
CID 84647801

Frequently Asked Questions

What is the IUPAC name of 2,3,3-trifluoro-2-methylpropan-1-amine?
The IUPAC name of 2,3,3-trifluoro-2-methylpropan-1-amine (CID 112565083) is 2,3,3-trifluoro-2-methylpropan-1-amine.
What is the SMILES notation for 2,3,3-trifluoro-2-methylpropan-1-amine?
The canonical SMILES for 2,3,3-trifluoro-2-methylpropan-1-amine is CC(F)(CN)C(F)F.
What is the InChIKey of 2,3,3-trifluoro-2-methylpropan-1-amine?
The InChIKey is SZVPFCBITFASKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8F3N/c1-4(7,2-8)3(5)6/h3H,2,8H2,1H3.
What are the key properties of 2,3,3-trifluoro-2-methylpropan-1-amine?
2,3,3-trifluoro-2-methylpropan-1-amine has a molecular weight of 127.11 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3-trifluoro-2-methylpropan-1-amine is sourced from PubChem (CID 112565083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).