(3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine

C15H16FNO — CID 44592121

IUPAC(3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine
SMILESFc1ccc2cc(CO[C@@H]3CCNC3)ccc2c1
InChIInChI=1S/C15H16FNO/c16-14-4-3-12-7-11(1-2-13(12)8-14)10-18-15-5-6-17-9-15/h1-4,7-8,15,17H,5-6,9-10H2/t15-/m1/s1
InChIKeyLMGLVWVNPWWAAK-OAHLLOKOSA-N
MW245.30 g/mol
LogP2.86
Rot. Bonds3

About (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine

(3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine (PubChem CID 44592121) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine.

Molecular Properties

Compound Name(3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine
PubChem CID44592121
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name(3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine
SMILESFc1ccc2cc(CO[C@@H]3CCNC3)ccc2c1
InChIInChI=1S/C15H16FNO/c16-14-4-3-12-7-11(1-2-13(12)8-14)10-18-15-5-6-17-9-15/h1-4,7-8,15,17H,5-6,9-10H2/t15-/m1/s1
InChIKeyLMGLVWVNPWWAAK-OAHLLOKOSA-N
XLogP2.86
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine?
The IUPAC name of (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine (CID 44592121) is (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine.
What is the SMILES notation for (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine?
The canonical SMILES for (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine is Fc1ccc2cc(CO[C@@H]3CCNC3)ccc2c1.
What is the InChIKey of (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine?
The InChIKey is LMGLVWVNPWWAAK-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H16FNO/c16-14-4-3-12-7-11(1-2-13(12)8-14)10-18-15-5-6-17-9-15/h1-4,7-8,15,17H,5-6,9-10H2/t15-/m1/s1.
What are the key properties of (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine?
(3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine has a molecular weight of 245.30 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[(6-fluoronaphthalen-2-yl)methoxy]pyrrolidine is sourced from PubChem (CID 44592121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).