(2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine

C15H21FN2 — CID 166397619

IUPAC(2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine
SMILESC[C@@H](N)CN1CC2(CCCC2)c2c(F)cccc21
InChIInChI=1S/C15H21FN2/c1-11(17)9-18-10-15(7-2-3-8-15)14-12(16)5-4-6-13(14)18/h4-6,11H,2-3,7-10,17H2,1H3/t11-/m1/s1
InChIKeyYCLXBHNOGPLUIP-LLVKDONJSA-N
MW248.34 g/mol
LogP2.80
Rot. Bonds2

About (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine

(2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine (PubChem CID 166397619) has the molecular formula C15H21FN2 and a molecular weight of 248.34 g/mol. Its IUPAC name is (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine.

Molecular Properties

Compound Name(2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine
PubChem CID166397619
Molecular FormulaC15H21FN2
Molecular Weight248.34 g/mol
Exact Mass248.17
IUPAC Name(2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine
SMILESC[C@@H](N)CN1CC2(CCCC2)c2c(F)cccc21
InChIInChI=1S/C15H21FN2/c1-11(17)9-18-10-15(7-2-3-8-15)14-12(16)5-4-6-13(14)18/h4-6,11H,2-3,7-10,17H2,1H3/t11-/m1/s1
InChIKeyYCLXBHNOGPLUIP-LLVKDONJSA-N
XLogP2.80
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.34
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine?
The IUPAC name of (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine (CID 166397619) is (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine.
What is the SMILES notation for (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine?
The canonical SMILES for (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine is C[C@@H](N)CN1CC2(CCCC2)c2c(F)cccc21.
What is the InChIKey of (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine?
The InChIKey is YCLXBHNOGPLUIP-LLVKDONJSA-N. The full InChI is InChI=1S/C15H21FN2/c1-11(17)9-18-10-15(7-2-3-8-15)14-12(16)5-4-6-13(14)18/h4-6,11H,2-3,7-10,17H2,1H3/t11-/m1/s1.
What are the key properties of (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine?
(2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine has a molecular weight of 248.34 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(4-fluorospiro[2H-indole-3,1'-cyclopentane]-1-yl)propan-2-amine is sourced from PubChem (CID 166397619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).