N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine

C17H24FN — CID 116530769

IUPACN-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine
SMILESFc1ccc2c(c1)CCC2NC1CCCCCCC1
InChIInChI=1S/C17H24FN/c18-14-9-10-16-13(12-14)8-11-17(16)19-15-6-4-2-1-3-5-7-15/h9-10,12,15,17,19H,1-8,11H2
InChIKeyKRFOZUSZONZQRV-UHFFFAOYSA-N
MW261.38 g/mol
LogP4.52
Rot. Bonds2

About N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine

N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine (PubChem CID 116530769) has the molecular formula C17H24FN and a molecular weight of 261.38 g/mol. Its IUPAC name is N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine
PubChem CID116530769
Molecular FormulaC17H24FN
Molecular Weight261.38 g/mol
Exact Mass261.19
IUPAC NameN-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine
SMILESFc1ccc2c(c1)CCC2NC1CCCCCCC1
InChIInChI=1S/C17H24FN/c18-14-9-10-16-13(12-14)8-11-17(16)19-15-6-4-2-1-3-5-7-15/h9-10,12,15,17,19H,1-8,11H2
InChIKeyKRFOZUSZONZQRV-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

5-chloro-N-cyclopentyl-2,3-dihydro-1H-inden-1-amine
CID 81301651
N-cyclopropyl-6-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83907357
N-(cyclohexylmethyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116530842
N-(3-ethoxycyclobutyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 103917688
N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 115714273
N-cyclooctyl-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83065945
N-(2,6-dichlorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116531042
N-[(1S)-5-fluoro-2,3-dihydro-1H-inden-1-yl]cyclobutanecarboxamide
CID 94198795
6-chloro-N-cyclopentyl-2,3-dihydro-1H-inden-1-amine
CID 115867576
5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine
CID 116530824
5-fluoro-N-[(2-methylpropan-2-yl)oxy]-2,3-dihydro-1H-inden-1-amine
CID 116531106
N-cyclohexyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43094582

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine (CID 116530769) is N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine is Fc1ccc2c(c1)CCC2NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine?
The InChIKey is KRFOZUSZONZQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FN/c18-14-9-10-16-13(12-14)8-11-17(16)19-15-6-4-2-1-3-5-7-15/h9-10,12,15,17,19H,1-8,11H2.
What are the key properties of N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine?
N-cyclooctyl-5-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-5-fluoro-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 116530769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).