2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine

C13H18FN — CID 105460924

IUPAC2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
SMILESCNC(C)(C)C1CCc2cccc(F)c21
InChIInChI=1S/C13H18FN/c1-13(2,15-3)10-8-7-9-5-4-6-11(14)12(9)10/h4-6,10,15H,7-8H2,1-3H3
InChIKeyYSOFRFIDRZYKCS-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.85
Rot. Bonds2

About 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine

2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine (PubChem CID 105460924) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
PubChem CID105460924
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
SMILESCNC(C)(C)C1CCc2cccc(F)c21
InChIInChI=1S/C13H18FN/c1-13(2,15-3)10-8-7-9-5-4-6-11(14)12(9)10/h4-6,10,15H,7-8H2,1-3H3
InChIKeyYSOFRFIDRZYKCS-UHFFFAOYSA-N
XLogP2.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
CID 105474790
2-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
CID 105460921
(1S)-7-fluoro-1-methyl-2,3-dihydro-1H-indene
CID 89205877
2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)propan-2-yl 2-methylprop-2-enoate
CID 89474733
7-fluoro-2,3-dihydro-1H-inden-1-amine
CID 58440160
(1S)-8-fluoro-N-methyl-3,4-dihydro-1H-isochromen-1-amine
CID 175402532
N-methyl-2-(6-methyl-2,3-dihydro-1H-inden-1-yl)propan-2-amine
CID 105455820
2-(8-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)propan-2-yl 2-methylprop-2-enoate
CID 89474755
8-fluoro-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
CID 115056927
1-[(3S)-9-fluoro-3-propan-2-yl-1,3,4,5-tetrahydro-2-benzoxepin-1-yl]-N-methylmethanamine
CID 165409740
N-(2-cyclopropylpropan-2-yl)-2-fluorobenzenesulfonamide
CID 103697710
2-cyclopropyl-N-[(2,3-difluorophenyl)methyl]propan-2-amine
CID 103700276

Frequently Asked Questions

What is the IUPAC name of 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine?
The IUPAC name of 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine (CID 105460924) is 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine?
The canonical SMILES for 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine is CNC(C)(C)C1CCc2cccc(F)c21.
What is the InChIKey of 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine?
The InChIKey is YSOFRFIDRZYKCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-13(2,15-3)10-8-7-9-5-4-6-11(14)12(9)10/h4-6,10,15H,7-8H2,1-3H3.
What are the key properties of 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine?
2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine has a molecular weight of 207.29 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 105460924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).