1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol

C17H24FNO — CID 71187915

IUPAC1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol
SMILESCc1c(F)ccc2c1C(O)(C1CCCC1N)C(C)(C)C2
InChIInChI=1S/C17H24FNO/c1-10-13(18)8-7-11-9-16(2,3)17(20,15(10)11)12-5-4-6-14(12)19/h7-8,12,14,20H,4-6,9,19H2,1-3H3
InChIKeyKEVOUUIMMDMORK-UHFFFAOYSA-N
MW277.38 g/mol
LogP3.03
Rot. Bonds1

About 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol

1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol (PubChem CID 71187915) has the molecular formula C17H24FNO and a molecular weight of 277.38 g/mol. Its IUPAC name is 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol.

Molecular Properties

Compound Name1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol
PubChem CID71187915
Molecular FormulaC17H24FNO
Molecular Weight277.38 g/mol
Exact Mass277.18
IUPAC Name1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol
SMILESCc1c(F)ccc2c1C(O)(C1CCCC1N)C(C)(C)C2
InChIInChI=1S/C17H24FNO/c1-10-13(18)8-7-11-9-16(2,3)17(20,15(10)11)12-5-4-6-14(12)19/h7-8,12,14,20H,4-6,9,19H2,1-3H3
InChIKeyKEVOUUIMMDMORK-UHFFFAOYSA-N
XLogP3.03
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.38
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

9-(1-Aminopropan-2-yl)-9H-fluoren-9-ol--hydrogen chloride (1/1)
CID 27024
1-(2-aminoethyl)-2,3-dihydro-1H-inden-1-ol hydrochloride
CID 139026737
9-(1-Aminopropan-2-yl)fluoren-9-ol
CID 27025
1-(2-amino-3,3-dimethylcyclopentyl)-7-bromo-6-fluoro-2,2-dimethyl-3H-inden-1-ol
CID 58951003
6-fluoro-2,2-dimethyl-1-piperidin-4-yl-3H-inden-1-ol
CID 58951185
9-(2-Aminoethyl)-5-fluoro-2-methylfluoren-9-ol
CID 59757171
4,6-difluoro-2,2,7-trimethyl-1-piperidin-4-yl-3H-inden-1-ol
CID 143203274
[1-(Aminomethyl)-2,3-dihydroinden-1-yl]-(4-fluoro-3-methylphenyl)methanol
CID 79124331
[2-(Aminomethyl)-1,3-dihydroinden-2-yl]-(4-fluoro-3-methylphenyl)methanol
CID 79124334
1-[1-(Aminomethyl)-2,3-dihydroinden-1-yl]-1-(4-fluorophenyl)ethanol
CID 79125131
1-[2-(Aminomethyl)-1,3-dihydroinden-2-yl]-1-(4-fluorophenyl)ethanol
CID 79125134
1-[1-(Aminomethyl)-2,3-dihydroinden-1-yl]-1-(3-fluorophenyl)ethanol
CID 79125135

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol?
The IUPAC name of 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol (CID 71187915) is 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol.
What is the SMILES notation for 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol?
The canonical SMILES for 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol is Cc1c(F)ccc2c1C(O)(C1CCCC1N)C(C)(C)C2.
What is the InChIKey of 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol?
The InChIKey is KEVOUUIMMDMORK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FNO/c1-10-13(18)8-7-11-9-16(2,3)17(20,15(10)11)12-5-4-6-14(12)19/h7-8,12,14,20H,4-6,9,19H2,1-3H3.
What are the key properties of 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol?
1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol has a molecular weight of 277.38 g/mol, XLogP of 3.03, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminocyclopentyl)-6-fluoro-2,2,7-trimethyl-3H-inden-1-ol is sourced from PubChem (CID 71187915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).