(2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine

C7H12FN — CID 171036623

IUPAC(2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine
SMILESNCC1(F)CCC2CC21
InChIInChI=1S/C7H12FN/c8-7(4-9)2-1-5-3-6(5)7/h5-6H,1-4,9H2
InChIKeyAGFMZCUKBVSZSI-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.08
Rot. Bonds1

About (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine

(2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine (PubChem CID 171036623) has the molecular formula C7H12FN and a molecular weight of 129.18 g/mol. Its IUPAC name is (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine.

Molecular Properties

Compound Name(2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine
PubChem CID171036623
Molecular FormulaC7H12FN
Molecular Weight129.18 g/mol
Exact Mass129.10
IUPAC Name(2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine
SMILESNCC1(F)CCC2CC21
InChIInChI=1S/C7H12FN/c8-7(4-9)2-1-5-3-6(5)7/h5-6H,1-4,9H2
InChIKeyAGFMZCUKBVSZSI-UHFFFAOYSA-N
XLogP1.08
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1,2-difluorocyclopentyl)methanamine
CID 84762418
[(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine
CID 165482670
2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine
CID 130525697
(1R,6S)-2,2-difluorobicyclo[4.1.0]heptane
CID 163491628
[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]methanamine
CID 130494579
2-(cyclopentylmethyl)bicyclo[3.1.0]hexan-2-ol
CID 130525906
[10-(aminomethyl)-4,10-dimethyl-4-tricyclo[6.3.1.02,7]dodecanyl]methanamine
CID 166919292
2-(aminomethyl)-N-benzyl-N-methylbicyclo[3.1.0]hexan-2-amine
CID 130525662
2-[2-(1-aminoethyl)-2-bicyclo[3.1.0]hexanyl]acetic acid
CID 130526334
2-(aminomethyl)-N-[(5-chlorothiophen-2-yl)methyl]-N-methylbicyclo[3.1.0]hexan-2-amine
CID 112740228
[2-(1,3-dihydroisoindol-2-yl)-2-bicyclo[4.1.0]heptanyl]methanamine
CID 112740240
spiro[bicyclo[4.1.0]heptane-2,1'-cyclopentane]
CID 140625385

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine?
The IUPAC name of (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine (CID 171036623) is (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine.
What is the SMILES notation for (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine?
The canonical SMILES for (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine is NCC1(F)CCC2CC21.
What is the InChIKey of (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine?
The InChIKey is AGFMZCUKBVSZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FN/c8-7(4-9)2-1-5-3-6(5)7/h5-6H,1-4,9H2.
What are the key properties of (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine?
(2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine has a molecular weight of 129.18 g/mol, XLogP of 1.08, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine is sourced from PubChem (CID 171036623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).