ethane;2-fluoro-2-methylpropan-1-amine

C6H16FN — CID 166112006

IUPACethane;2-fluoro-2-methylpropan-1-amine
SMILESCC.CC(C)(F)CN
InChIInChI=1S/C4H10FN.C2H6/c1-4(2,5)3-6;1-2/h3,6H2,1-2H3;1-2H3
InChIKeyRZOOEZFVRXOPTF-UHFFFAOYSA-N
MW121.20 g/mol
LogP1.72
Rot. Bonds1

About ethane;2-fluoro-2-methylpropan-1-amine

ethane;2-fluoro-2-methylpropan-1-amine (PubChem CID 166112006) has the molecular formula C6H16FN and a molecular weight of 121.20 g/mol. Its IUPAC name is ethane;2-fluoro-2-methylpropan-1-amine.

Molecular Properties

Compound Nameethane;2-fluoro-2-methylpropan-1-amine
PubChem CID166112006
Molecular FormulaC6H16FN
Molecular Weight121.20 g/mol
Exact Mass121.13
IUPAC Nameethane;2-fluoro-2-methylpropan-1-amine
SMILESCC.CC(C)(F)CN
InChIInChI=1S/C4H10FN.C2H6/c1-4(2,5)3-6;1-2/h3,6H2,1-2H3;1-2H3
InChIKeyRZOOEZFVRXOPTF-UHFFFAOYSA-N
XLogP1.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.20
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2,2-dimethylpropan-1-amine;ethane;methanol
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2,2-difluoropropane;ethane
CID 144524394
2,3,3-trifluoro-2-methylpropan-1-amine
CID 112565083
2,2-dimethylpropane-1,3-diamine
CID 162099967
2-methyl-2-(trifluoromethoxy)propan-1-amine
CID 130569950
3-amino-1,1,1-trifluoro-2-methylpropan-2-ol;hydrochloride
CID 71757351
2-fluoro-2-methylpentan-1-amine
CID 84716027
2,2-dimethylpropane;ethane;2-fluoro-2-methylpropane
CID 142473666
2-fluoro-2,3-dimethylbut-3-en-1-amine
CID 112565253

Frequently Asked Questions

What is the IUPAC name of ethane;2-fluoro-2-methylpropan-1-amine?
The IUPAC name of ethane;2-fluoro-2-methylpropan-1-amine (CID 166112006) is ethane;2-fluoro-2-methylpropan-1-amine.
What is the SMILES notation for ethane;2-fluoro-2-methylpropan-1-amine?
The canonical SMILES for ethane;2-fluoro-2-methylpropan-1-amine is CC.CC(C)(F)CN.
What is the InChIKey of ethane;2-fluoro-2-methylpropan-1-amine?
The InChIKey is RZOOEZFVRXOPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FN.C2H6/c1-4(2,5)3-6;1-2/h3,6H2,1-2H3;1-2H3.
What are the key properties of ethane;2-fluoro-2-methylpropan-1-amine?
ethane;2-fluoro-2-methylpropan-1-amine has a molecular weight of 121.20 g/mol, XLogP of 1.72, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-fluoro-2-methylpropan-1-amine is sourced from PubChem (CID 166112006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).