(6R)-6-fluoro-3-methyl-1,3-oxazocane

C7H14FNO — CID 138637089

IUPAC(6R)-6-fluoro-3-methyl-1,3-oxazocane
SMILESCN1CC[C@@H](F)CCOC1
InChIInChI=1S/C7H14FNO/c1-9-4-2-7(8)3-5-10-6-9/h7H,2-6H2,1H3/t7-/m1/s1
InChIKeyFTFVKACYGSIDLV-SSDOTTSWSA-N
MW147.19 g/mol
LogP1.02
Rot. Bonds

About (6R)-6-fluoro-3-methyl-1,3-oxazocane

(6R)-6-fluoro-3-methyl-1,3-oxazocane (PubChem CID 138637089) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is (6R)-6-fluoro-3-methyl-1,3-oxazocane.

Molecular Properties

Compound Name(6R)-6-fluoro-3-methyl-1,3-oxazocane
PubChem CID138637089
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name(6R)-6-fluoro-3-methyl-1,3-oxazocane
SMILESCN1CC[C@@H](F)CCOC1
InChIInChI=1S/C7H14FNO/c1-9-4-2-7(8)3-5-10-6-9/h7H,2-6H2,1H3/t7-/m1/s1
InChIKeyFTFVKACYGSIDLV-SSDOTTSWSA-N
XLogP1.02
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6R)-6-fluoro-3-methyl-1,3-oxazocane?
The IUPAC name of (6R)-6-fluoro-3-methyl-1,3-oxazocane (CID 138637089) is (6R)-6-fluoro-3-methyl-1,3-oxazocane.
What is the SMILES notation for (6R)-6-fluoro-3-methyl-1,3-oxazocane?
The canonical SMILES for (6R)-6-fluoro-3-methyl-1,3-oxazocane is CN1CC[C@@H](F)CCOC1.
What is the InChIKey of (6R)-6-fluoro-3-methyl-1,3-oxazocane?
The InChIKey is FTFVKACYGSIDLV-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H14FNO/c1-9-4-2-7(8)3-5-10-6-9/h7H,2-6H2,1H3/t7-/m1/s1.
What are the key properties of (6R)-6-fluoro-3-methyl-1,3-oxazocane?
(6R)-6-fluoro-3-methyl-1,3-oxazocane has a molecular weight of 147.19 g/mol, XLogP of 1.02, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-fluoro-3-methyl-1,3-oxazocane is sourced from PubChem (CID 138637089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).