7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol

C7H12FNO — CID 122450702

IUPAC7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol
SMILESCN1CC2C(O)C(F)C2C1
InChIInChI=1S/C7H12FNO/c1-9-2-4-5(3-9)7(10)6(4)8/h4-7,10H,2-3H2,1H3
InChIKeyGTOWPYVLRZARLI-UHFFFAOYSA-N
MW145.18 g/mol
LogP-0.12
Rot. Bonds

About 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol

7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol (PubChem CID 122450702) has the molecular formula C7H12FNO and a molecular weight of 145.18 g/mol. Its IUPAC name is 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol.

Molecular Properties

Compound Name7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol
PubChem CID122450702
Molecular FormulaC7H12FNO
Molecular Weight145.18 g/mol
Exact Mass145.09
IUPAC Name7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol
SMILESCN1CC2C(O)C(F)C2C1
InChIInChI=1S/C7H12FNO/c1-9-2-4-5(3-9)7(10)6(4)8/h4-7,10H,2-3H2,1H3
InChIKeyGTOWPYVLRZARLI-UHFFFAOYSA-N
XLogP-0.12
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.18
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol?
The IUPAC name of 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol (CID 122450702) is 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol.
What is the SMILES notation for 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol?
The canonical SMILES for 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol is CN1CC2C(O)C(F)C2C1.
What is the InChIKey of 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol?
The InChIKey is GTOWPYVLRZARLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FNO/c1-9-2-4-5(3-9)7(10)6(4)8/h4-7,10H,2-3H2,1H3.
What are the key properties of 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol?
7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol has a molecular weight of 145.18 g/mol, XLogP of -0.12, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol is sourced from PubChem (CID 122450702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).