N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine

C17H24FN — CID 83065945

IUPACN-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine
SMILESFc1cccc2c1CCC2NC1CCCCCCC1
InChIInChI=1S/C17H24FN/c18-16-10-6-9-15-14(16)11-12-17(15)19-13-7-4-2-1-3-5-8-13/h6,9-10,13,17,19H,1-5,7-8,11-12H2
InChIKeyIMSQGGPHNJSHHL-UHFFFAOYSA-N
MW261.38 g/mol
LogP4.52
Rot. Bonds2

About N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine

N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine (PubChem CID 83065945) has the molecular formula C17H24FN and a molecular weight of 261.38 g/mol. Its IUPAC name is N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine
PubChem CID83065945
Molecular FormulaC17H24FN
Molecular Weight261.38 g/mol
Exact Mass261.19
IUPAC NameN-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine
SMILESFc1cccc2c1CCC2NC1CCCCCCC1
InChIInChI=1S/C17H24FN/c18-16-10-6-9-15-14(16)11-12-17(15)19-13-7-4-2-1-3-5-8-13/h6,9-10,13,17,19H,1-5,7-8,11-12H2
InChIKeyIMSQGGPHNJSHHL-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.38
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-ethylcyclohexyl)-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83067007
4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
CID 83065400
N-[(1R)-1-cyclopentylethyl]-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83065507
4-fluoro-N-(2-methylsulfanylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
CID 103779434
4-fluoro-N-(2-methoxycyclopentyl)-2,3-dihydro-1H-inden-1-amine
CID 81334417
N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116530769
N-[3-(2-fluorophenyl)cyclobutyl]cyclooctanamine
CID 43633190
4-fluoro-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 61383392
N-(4-chlorophenyl)-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83067484
N-(3,5-difluorophenyl)-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 79483667
1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(2-methylcyclohexyl)urea
CID 86838302
4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 83067325

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine (CID 83065945) is N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine is Fc1cccc2c1CCC2NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine?
The InChIKey is IMSQGGPHNJSHHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FN/c18-16-10-6-9-15-14(16)11-12-17(15)19-13-7-4-2-1-3-5-8-13/h6,9-10,13,17,19H,1-5,7-8,11-12H2.
What are the key properties of N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine?
N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine has a molecular weight of 261.38 g/mol, XLogP of 4.52, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 83065945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).