1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol

C15H13ClFNO — CID 107682700

IUPAC1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol
SMILESOc1ccc2c(c1)CCC2Nc1c(F)cccc1Cl
InChIInChI=1S/C15H13ClFNO/c16-12-2-1-3-13(17)15(12)18-14-7-4-9-8-10(19)5-6-11(9)14/h1-3,5-6,8,14,18-19H,4,7H2
InChIKeyHFCFAGNGBBYTDQ-UHFFFAOYSA-N
MW277.73 g/mol
LogP4.28
Rot. Bonds2

About 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol

1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol (PubChem CID 107682700) has the molecular formula C15H13ClFNO and a molecular weight of 277.73 g/mol. Its IUPAC name is 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol
PubChem CID107682700
Molecular FormulaC15H13ClFNO
Molecular Weight277.73 g/mol
Exact Mass277.07
IUPAC Name1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol
SMILESOc1ccc2c(c1)CCC2Nc1c(F)cccc1Cl
InChIInChI=1S/C15H13ClFNO/c16-12-2-1-3-13(17)15(12)18-14-7-4-9-8-10(19)5-6-11(9)14/h1-3,5-6,8,14,18-19H,4,7H2
InChIKeyHFCFAGNGBBYTDQ-UHFFFAOYSA-N
XLogP4.28
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.73
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dichlorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116531042
1-(2,4,6-trifluoroanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682439
5-chloro-N-(2-chloro-4,6-difluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 83081805
1-(4-bromo-2,5-difluoroanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682773
1-[1-(2,6-difluorophenyl)ethylamino]-2,3-dihydro-1H-inden-5-ol
CID 107682182
1-(2,5-dichloro-4-methylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682645
4-fluoro-3-[(5-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]benzoic acid
CID 107682090
N-(2,6-dichloro-4-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 83077299
1-(4-bromo-2,6-dimethylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682184
1-(4-fluoro-3-methoxyanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682716
2-fluoro-5-[(5-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]benzoic acid
CID 107682089
1-(4-hydroxy-2-methylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682398

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol (CID 107682700) is 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol is Oc1ccc2c(c1)CCC2Nc1c(F)cccc1Cl.
What is the InChIKey of 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol?
The InChIKey is HFCFAGNGBBYTDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO/c16-12-2-1-3-13(17)15(12)18-14-7-4-9-8-10(19)5-6-11(9)14/h1-3,5-6,8,14,18-19H,4,7H2.
What are the key properties of 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol?
1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol has a molecular weight of 277.73 g/mol, XLogP of 4.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-fluoroanilino)-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 107682700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).