4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine

C18H26FN — CID 83065400

IUPAC4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
SMILESCC(C)C1CCCCC1NC1CCc2c(F)cccc21
InChIInChI=1S/C18H26FN/c1-12(2)13-6-3-4-9-17(13)20-18-11-10-14-15(18)7-5-8-16(14)19/h5,7-8,12-13,17-18,20H,3-4,6,9-11H2,1-2H3
InChIKeyRPWNUYIEOGMHDJ-UHFFFAOYSA-N
MW275.41 g/mol
LogP4.62
Rot. Bonds3

About 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine

4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 83065400) has the molecular formula C18H26FN and a molecular weight of 275.41 g/mol. Its IUPAC name is 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID83065400
Molecular FormulaC18H26FN
Molecular Weight275.41 g/mol
Exact Mass275.20
IUPAC Name4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
SMILESCC(C)C1CCCCC1NC1CCc2c(F)cccc21
InChIInChI=1S/C18H26FN/c1-12(2)13-6-3-4-9-17(13)20-18-11-10-14-15(18)7-5-8-16(14)19/h5,7-8,12-13,17-18,20H,3-4,6,9-11H2,1-2H3
InChIKeyRPWNUYIEOGMHDJ-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.41
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83065945
N-[(1R)-1-cyclopentylethyl]-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83065507
4-fluoro-N-(3-methylpentan-2-yl)-2,3-dihydro-1H-inden-1-amine
CID 79492992
1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(2-methylcyclohexyl)urea
CID 86838302
4-fluoro-N-[1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 78956060
4-fluoro-N-(3-methyl-2-propan-2-ylbutyl)-2,3-dihydro-1H-inden-1-amine
CID 102904112
(2R)-2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]propan-1-ol
CID 114987002
4-fluoro-N-[(1S)-1-(4-fluorophenyl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 83067010
(2R)-2-amino-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)propanamide
CID 119302149
N-(3-ethylcyclohexyl)-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83067007

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine (CID 83065400) is 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine is CC(C)C1CCCCC1NC1CCc2c(F)cccc21.
What is the InChIKey of 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is RPWNUYIEOGMHDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FN/c1-12(2)13-6-3-4-9-17(13)20-18-11-10-14-15(18)7-5-8-16(14)19/h5,7-8,12-13,17-18,20H,3-4,6,9-11H2,1-2H3.
What are the key properties of 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine?
4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 275.41 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 83065400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).