1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]

C18H16FN — CID 175924515

IUPAC1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]
SMILESFc1cccc2c1C1(C=C2)CN(Cc2ccccc2)C1
InChIInChI=1S/C18H16FN/c19-16-8-4-7-15-9-10-18(17(15)16)12-20(13-18)11-14-5-2-1-3-6-14/h1-10H,11-13H2
InChIKeyCTFROBYGOBYYSY-UHFFFAOYSA-N
MW265.33 g/mol
LogP3.61
Rot. Bonds2

About 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]

1-benzyl-7'-fluorospiro[azetidine-3,1'-indene] (PubChem CID 175924515) has the molecular formula C18H16FN and a molecular weight of 265.33 g/mol. Its IUPAC name is 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene].

Molecular Properties

Compound Name1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]
PubChem CID175924515
Molecular FormulaC18H16FN
Molecular Weight265.33 g/mol
Exact Mass265.13
IUPAC Name1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]
SMILESFc1cccc2c1C1(C=C2)CN(Cc2ccccc2)C1
InChIInChI=1S/C18H16FN/c19-16-8-4-7-15-9-10-18(17(15)16)12-20(13-18)11-14-5-2-1-3-6-14/h1-10H,11-13H2
InChIKeyCTFROBYGOBYYSY-UHFFFAOYSA-N
XLogP3.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1-benzyl-3-chloro-3-ethylazetidine
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1-benzyl-3-methylazetidin-3-ol;hydrochloride
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CID 12887958
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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]?
The IUPAC name of 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene] (CID 175924515) is 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene].
What is the SMILES notation for 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]?
The canonical SMILES for 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene] is Fc1cccc2c1C1(C=C2)CN(Cc2ccccc2)C1.
What is the InChIKey of 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]?
The InChIKey is CTFROBYGOBYYSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN/c19-16-8-4-7-15-9-10-18(17(15)16)12-20(13-18)11-14-5-2-1-3-6-14/h1-10H,11-13H2.
What are the key properties of 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene]?
1-benzyl-7'-fluorospiro[azetidine-3,1'-indene] has a molecular weight of 265.33 g/mol, XLogP of 3.61, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-7'-fluorospiro[azetidine-3,1'-indene] is sourced from PubChem (CID 175924515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).