(1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine

C7H12FN — CID 124709518

IUPAC(1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine
SMILESN[C@H]1C[C@H]2CC[C@H]1[C@@H]2F
InChIInChI=1S/C7H12FN/c8-7-4-1-2-5(7)6(9)3-4/h4-7H,1-3,9H2/t4-,5-,6+,7-/m1/s1
InChIKeyLINBZZJFGKMWRL-MVIOUDGNSA-N
MW129.18 g/mol
LogP1.08
Rot. Bonds

About (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine

(1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine (PubChem CID 124709518) has the molecular formula C7H12FN and a molecular weight of 129.18 g/mol. Its IUPAC name is (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound Name(1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine
PubChem CID124709518
Molecular FormulaC7H12FN
Molecular Weight129.18 g/mol
Exact Mass129.10
IUPAC Name(1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine
SMILESN[C@H]1C[C@H]2CC[C@H]1[C@@H]2F
InChIInChI=1S/C7H12FN/c8-7-4-1-2-5(7)6(9)3-4/h4-7H,1-3,9H2/t4-,5-,6+,7-/m1/s1
InChIKeyLINBZZJFGKMWRL-MVIOUDGNSA-N
XLogP1.08
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
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

(1R,2R,4R,7S)-2-aminobicyclo[2.2.1]heptan-7-ol
CID 98069750
7-fluorobicyclo[2.2.1]heptan-2-ol
CID 130149072
cis-(1R,2S)-2-cyclopropylcyclopropan-1-amine
CID 91654438
(1R,2S,5R,6R)-6-fluorobicyclo[3.1.0]hexan-2-amine
CID 141035440
(1R,6S,7R)-bicyclo[4.2.0]octan-7-amine
CID 124833630
pentacyclo[6.5.1.13,6.02,7.09,13]pentadecane-4,12-diamine
CID 139623420
2-cyclopropylcyclobutan-1-amine;hydrochloride
CID 71743824
2-fluorocyclopropan-1-amine
CID 10197614
(1S,7S,8R)-bicyclo[5.2.0]nonan-8-amine;hydrochloride
CID 138987457
(1S,7S)-tricyclo[5.2.1.02,6]decan-8-amine
CID 166642246
(1S,2R,6R,7S)-tricyclo[5.2.1.02,6]decan-8-amine
CID 11378594
N-[(1R,2S,4S,7S)-7-fluoro-2-bicyclo[2.2.1]heptanyl]acetamide
CID 15811994

Frequently Asked Questions

What is the IUPAC name of (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine?
The IUPAC name of (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine (CID 124709518) is (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine is N[C@H]1C[C@H]2CC[C@H]1[C@@H]2F.
What is the InChIKey of (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine?
The InChIKey is LINBZZJFGKMWRL-MVIOUDGNSA-N. The full InChI is InChI=1S/C7H12FN/c8-7-4-1-2-5(7)6(9)3-4/h4-7H,1-3,9H2/t4-,5-,6+,7-/m1/s1.
What are the key properties of (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine?
(1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine has a molecular weight of 129.18 g/mol, XLogP of 1.08, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S,4R,7R)-7-fluorobicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 124709518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).