5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine

C16H15F2NO — CID 107683060

IUPAC5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine
SMILESNC1CCc2cc(OCc3ccc(F)cc3F)ccc21
InChIInChI=1S/C16H15F2NO/c17-12-3-1-11(15(18)8-12)9-20-13-4-5-14-10(7-13)2-6-16(14)19/h1,3-5,7-8,16H,2,6,9,19H2
InChIKeyCFVRHMIONWDCCY-UHFFFAOYSA-N
MW275.30 g/mol
LogP3.49
Rot. Bonds3

About 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine

5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine (PubChem CID 107683060) has the molecular formula C16H15F2NO and a molecular weight of 275.30 g/mol. Its IUPAC name is 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine
PubChem CID107683060
Molecular FormulaC16H15F2NO
Molecular Weight275.30 g/mol
Exact Mass275.11
IUPAC Name5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine
SMILESNC1CCc2cc(OCc3ccc(F)cc3F)ccc21
InChIInChI=1S/C16H15F2NO/c17-12-3-1-11(15(18)8-12)9-20-13-4-5-14-10(7-13)2-6-16(14)19/h1,3-5,7-8,16H,2,6,9,19H2
InChIKeyCFVRHMIONWDCCY-UHFFFAOYSA-N
XLogP3.49
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-ol
CID 107684733
2-[(1-amino-2,3-dihydro-1H-inden-5-yl)oxymethyl]-4-fluorobenzonitrile
CID 107902761
5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 16666328
(1R)-5-[(3-bromo-2,6-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine
CID 106263043
5-[(2,4-difluorophenyl)methoxy]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65454214
5-[(2,6-dimethylphenyl)methoxy]-2,3-dihydro-1H-inden-1-amine
CID 107682901
2,4-difluoro-1-[(4-fluorophenoxy)methyl]benzene
CID 64765828
(1S)-5-ethoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 70817218
5-[(3-methylphenyl)methoxy]-2,3-dihydro-1H-inden-1-amine
CID 107682898
5-(1,3-thiazol-2-ylmethoxy)-2,3-dihydro-1H-inden-1-amine
CID 107683014
5-[(2-chloro-4-fluorophenyl)methoxy]-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 107683254
4-[(1-amino-2,3-dihydro-1H-inden-5-yl)oxymethyl]benzoic acid
CID 107683179

Frequently Asked Questions

What is the IUPAC name of 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine (CID 107683060) is 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine is NC1CCc2cc(OCc3ccc(F)cc3F)ccc21.
What is the InChIKey of 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine?
The InChIKey is CFVRHMIONWDCCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO/c17-12-3-1-11(15(18)8-12)9-20-13-4-5-14-10(7-13)2-6-16(14)19/h1,3-5,7-8,16H,2,6,9,19H2.
What are the key properties of 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine?
5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine has a molecular weight of 275.30 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,4-difluorophenyl)methoxy]-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 107683060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).