N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine

C16H16FNO — CID 79367397

IUPACN-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
SMILESCOc1ccc2c(c1)C(Nc1cccc(F)c1)CC2
InChIInChI=1S/C16H16FNO/c1-19-14-7-5-11-6-8-16(15(11)10-14)18-13-4-2-3-12(17)9-13/h2-5,7,9-10,16,18H,6,8H2,1H3
InChIKeyGDEMIRHBKRWZPR-UHFFFAOYSA-N
MW257.31 g/mol
LogP3.93
Rot. Bonds3

About N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine

N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine (PubChem CID 79367397) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
PubChem CID79367397
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC NameN-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
SMILESCOc1ccc2c(c1)C(Nc1cccc(F)c1)CC2
InChIInChI=1S/C16H16FNO/c1-19-14-7-5-11-6-8-16(15(11)10-14)18-13-4-2-3-12(17)9-13/h2-5,7,9-10,16,18H,6,8H2,1H3
InChIKeyGDEMIRHBKRWZPR-UHFFFAOYSA-N
XLogP3.93
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluorophenyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79239496
5-fluoro-N-(3-methoxyphenyl)-2,3-dihydro-1H-inden-1-amine
CID 115916737
6-methoxy-N-(3,4,5-trifluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 79370051
N-(4-fluoro-2-methoxyphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79370032
7-methoxy-N-(3-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79239327
6-methoxy-N-(4-methylsulfanylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 79367211
N-(2,6-dichloro-4-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 83078051
N-(2-chloro-4-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79367032
N-(3-ethylphenyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79232093
N-(4-bromo-3,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 107572282
N-(2,3-dihydro-1H-inden-1-yl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79369352
N-(5-bromo-2,4-difluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 102852883

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine (CID 79367397) is N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine is COc1ccc2c(c1)C(Nc1cccc(F)c1)CC2.
What is the InChIKey of N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine?
The InChIKey is GDEMIRHBKRWZPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c1-19-14-7-5-11-6-8-16(15(11)10-14)18-13-4-2-3-12(17)9-13/h2-5,7,9-10,16,18H,6,8H2,1H3.
What are the key properties of N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine?
N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine has a molecular weight of 257.31 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 79367397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).