(2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine

C18H19FN2O — CID 168939605

IUPAC(2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine
SMILESC[C@@H](N)Cn1ccc2cc(OCc3ccccc3F)ccc21
InChIInChI=1S/C18H19FN2O/c1-13(20)11-21-9-8-14-10-16(6-7-18(14)21)22-12-15-4-2-3-5-17(15)19/h2-10,13H,11-12,20H2,1H3/t13-/m1/s1
InChIKeyGEVMIWIVBASKBB-CYBMUJFWSA-N
MW298.36 g/mol
LogP3.71
Rot. Bonds5

About (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine

(2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine (PubChem CID 168939605) has the molecular formula C18H19FN2O and a molecular weight of 298.36 g/mol. Its IUPAC name is (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine.

Molecular Properties

Compound Name(2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine
PubChem CID168939605
Molecular FormulaC18H19FN2O
Molecular Weight298.36 g/mol
Exact Mass298.15
IUPAC Name(2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine
SMILESC[C@@H](N)Cn1ccc2cc(OCc3ccccc3F)ccc21
InChIInChI=1S/C18H19FN2O/c1-13(20)11-21-9-8-14-10-16(6-7-18(14)21)22-12-15-4-2-3-5-17(15)19/h2-10,13H,11-12,20H2,1H3/t13-/m1/s1
InChIKeyGEVMIWIVBASKBB-CYBMUJFWSA-N
XLogP3.71
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine?
The IUPAC name of (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine (CID 168939605) is (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine.
What is the SMILES notation for (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine?
The canonical SMILES for (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine is C[C@@H](N)Cn1ccc2cc(OCc3ccccc3F)ccc21.
What is the InChIKey of (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine?
The InChIKey is GEVMIWIVBASKBB-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H19FN2O/c1-13(20)11-21-9-8-14-10-16(6-7-18(14)21)22-12-15-4-2-3-5-17(15)19/h2-10,13H,11-12,20H2,1H3/t13-/m1/s1.
What are the key properties of (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine?
(2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine has a molecular weight of 298.36 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[5-[(2-fluorophenyl)methoxy]indol-1-yl]propan-2-amine is sourced from PubChem (CID 168939605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).