7,7-difluorobicyclo[2.2.1]heptan-2-amine

C7H11F2N — CID 71758529

IUPAC7,7-difluorobicyclo[2.2.1]heptan-2-amine
SMILESNC1CC2CCC1C2(F)F
InChIInChI=1S/C7H11F2N/c8-7(9)4-1-2-5(7)6(10)3-4/h4-6H,1-3,10H2
InChIKeyREKSYJSTVJQYJN-UHFFFAOYSA-N
MW147.17 g/mol
LogP1.38
Rot. Bonds

About 7,7-difluorobicyclo[2.2.1]heptan-2-amine

7,7-difluorobicyclo[2.2.1]heptan-2-amine (PubChem CID 71758529) has the molecular formula C7H11F2N and a molecular weight of 147.17 g/mol. Its IUPAC name is 7,7-difluorobicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound Name7,7-difluorobicyclo[2.2.1]heptan-2-amine
PubChem CID71758529
Molecular FormulaC7H11F2N
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name7,7-difluorobicyclo[2.2.1]heptan-2-amine
SMILESNC1CC2CCC1C2(F)F
InChIInChI=1S/C7H11F2N/c8-7(9)4-1-2-5(7)6(10)3-4/h4-6H,1-3,10H2
InChIKeyREKSYJSTVJQYJN-UHFFFAOYSA-N
XLogP1.38
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7,7-difluorobicyclo[2.2.1]heptane-2,5-diamine
CID 21301277
(3S,4S)-7,7-difluorobicyclo[4.1.0]heptane-3,4-diamine
CID 134438278
9,9-difluorobicyclo[3.3.1]nonan-3-amine
CID 154848948
4-amino-7,7-difluorobicyclo[4.1.0]heptan-3-ol
CID 130054075
3-(3,4-dimethylcyclohexyl)-3-fluorocyclobutan-1-amine
CID 112563947
[6-(aminomethyl)-7,7-difluoro-2-bicyclo[2.2.1]heptanyl]methanamine
CID 21301294
2-fluorocyclopropan-1-amine
CID 10197614
8,9-dimethyl-10-prop-1-enyltetracyclo[5.3.0.01,4.02,10]decane
CID 123834523
(1S,2R,5R)-6,6-difluorobicyclo[3.1.0]hexane-2-carboxylic acid
CID 166000589
2-(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)guanidine
CID 164655478
3,3-difluorotricyclo[2.2.1.02,6]heptan-1-amine
CID 170915230
(1R)-6,6-difluorotetracyclo[5.3.2.03,9.05,9]dodec-4-en-11-amine
CID 163625682

Frequently Asked Questions

What is the IUPAC name of 7,7-difluorobicyclo[2.2.1]heptan-2-amine?
The IUPAC name of 7,7-difluorobicyclo[2.2.1]heptan-2-amine (CID 71758529) is 7,7-difluorobicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for 7,7-difluorobicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for 7,7-difluorobicyclo[2.2.1]heptan-2-amine is NC1CC2CCC1C2(F)F.
What is the InChIKey of 7,7-difluorobicyclo[2.2.1]heptan-2-amine?
The InChIKey is REKSYJSTVJQYJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2N/c8-7(9)4-1-2-5(7)6(10)3-4/h4-6H,1-3,10H2.
What are the key properties of 7,7-difluorobicyclo[2.2.1]heptan-2-amine?
7,7-difluorobicyclo[2.2.1]heptan-2-amine has a molecular weight of 147.17 g/mol, XLogP of 1.38, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-difluorobicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 71758529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).