1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine

C14H19FN2 — CID 81494069

IUPAC1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(C2CCc3c(F)cccc32)C1
InChIInChI=1S/C14H19FN2/c1-16-10-7-8-17(9-10)14-6-5-11-12(14)3-2-4-13(11)15/h2-4,10,14,16H,5-9H2,1H3
InChIKeyKQWIXHTUQUZJBW-UHFFFAOYSA-N
MW234.32 g/mol
LogP2.11
Rot. Bonds2

About 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine

1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine (PubChem CID 81494069) has the molecular formula C14H19FN2 and a molecular weight of 234.32 g/mol. Its IUPAC name is 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine
PubChem CID81494069
Molecular FormulaC14H19FN2
Molecular Weight234.32 g/mol
Exact Mass234.15
IUPAC Name1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(C2CCc3c(F)cccc32)C1
InChIInChI=1S/C14H19FN2/c1-16-10-7-8-17(9-10)14-6-5-11-12(14)3-2-4-13(11)15/h2-4,10,14,16H,5-9H2,1H3
InChIKeyKQWIXHTUQUZJBW-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyrrolidin-2-yl]-N-methylmethanamine
CID 83069794
2-[1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]oxyacetic acid
CID 83059895
(3S)-3-[4-[(1R)-4-fluoro-2,3-dihydro-1H-inden-1-yl]piperazin-1-yl]thiolane 1,1-dioxide
CID 97339101
5-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-4-methyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 83069875
N-methyl-1-(9H-xanthen-9-yl)pyrrolidin-3-amine
CID 115300061
1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-methylpiperidin-4-amine
CID 83069719
1-[(1R)-4-fluoro-2,3-dihydro-1H-inden-1-yl]-4-(4-nitrophenyl)piperazine
CID 95786387
2-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
CID 105460921
1-[(2,6-difluorophenyl)methyl]-N-methylpyrrolidin-3-amine
CID 115300011
2-[4-[(5-fluoro-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]-N-methylacetamide
CID 75382694
4-fluoro-2,3-dihydro-1H-inden-1-amine;methanamine
CID 175262813
1-cyclopropyl-N-(2,6-difluorophenyl)pyrrolidin-3-amine
CID 62983179

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine?
The IUPAC name of 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine (CID 81494069) is 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine?
The canonical SMILES for 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine is CNC1CCN(C2CCc3c(F)cccc32)C1.
What is the InChIKey of 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine?
The InChIKey is KQWIXHTUQUZJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2/c1-16-10-7-8-17(9-10)14-6-5-11-12(14)3-2-4-13(11)15/h2-4,10,14,16H,5-9H2,1H3.
What are the key properties of 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine?
1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine has a molecular weight of 234.32 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-methylpyrrolidin-3-amine is sourced from PubChem (CID 81494069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).