[4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine

C16H16FNO — CID 28966366

IUPAC[4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine
SMILESNCc1ccc(Oc2ccc3c(c2)CCC3)c(F)c1
InChIInChI=1S/C16H16FNO/c17-15-8-11(10-18)4-7-16(15)19-14-6-5-12-2-1-3-13(12)9-14/h4-9H,1-3,10,18H2
InChIKeyGIXXBBRWTONROX-UHFFFAOYSA-N
MW257.31 g/mol
LogP3.57
Rot. Bonds3

About [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine

[4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine (PubChem CID 28966366) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine.

Molecular Properties

Compound Name[4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine
PubChem CID28966366
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC Name[4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine
SMILESNCc1ccc(Oc2ccc3c(c2)CCC3)c(F)c1
InChIInChI=1S/C16H16FNO/c17-15-8-11(10-18)4-7-16(15)19-14-6-5-12-2-1-3-13(12)9-14/h4-9H,1-3,10,18H2
InChIKeyGIXXBBRWTONROX-UHFFFAOYSA-N
XLogP3.57
TPSA35.25 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 ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2,3-dihydro-1H-inden-5-yloxy)-5-fluorophenyl]ethanamine
CID 63803303
[2-bromo-4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine
CID 107532626
[4-[4-(aminomethyl)-2-fluorophenoxy]phenyl]methanol
CID 61227389
[3-fluoro-4-(3-fluorophenoxy)phenyl]methanamine
CID 28966240
5,6,7,8-tetrahydronaphthalen-2-ylmethanamine;hydrochloride
CID 18993882
[6-(2,3-dihydro-1H-inden-5-yloxy)-3-pyridinyl]methanamine
CID 28824727
2-(2,3-dihydro-1H-inden-5-yloxy)-5-fluoro-4-methoxyaniline
CID 63599997
N-[3-fluoro-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]acetamide
CID 139760288
[3-fluoro-4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]methanamine
CID 28966135
[4-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methanol
CID 28946173
2-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 61070182
[4-(2,4-dichlorophenoxy)-3-fluorophenyl]methanamine
CID 28966222

Frequently Asked Questions

What is the IUPAC name of [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine?
The IUPAC name of [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine (CID 28966366) is [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine.
What is the SMILES notation for [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine?
The canonical SMILES for [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine is NCc1ccc(Oc2ccc3c(c2)CCC3)c(F)c1.
What is the InChIKey of [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine?
The InChIKey is GIXXBBRWTONROX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c17-15-8-11(10-18)4-7-16(15)19-14-6-5-12-2-1-3-13(12)9-14/h4-9H,1-3,10,18H2.
What are the key properties of [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine?
[4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine has a molecular weight of 257.31 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3-dihydro-1H-inden-5-yloxy)-3-fluorophenyl]methanamine is sourced from PubChem (CID 28966366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).