2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine

C16H16FN — CID 65409529

IUPAC2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine
SMILESNC(c1ccccc1F)C1Cc2ccccc2C1
InChIInChI=1S/C16H16FN/c17-15-8-4-3-7-14(15)16(18)13-9-11-5-1-2-6-12(11)10-13/h1-8,13,16H,9-10,18H2
InChIKeyDJOQSJYAQWKYID-UHFFFAOYSA-N
MW241.31 g/mol
LogP3.24
Rot. Bonds2

About 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine

2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine (PubChem CID 65409529) has the molecular formula C16H16FN and a molecular weight of 241.31 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine
PubChem CID65409529
Molecular FormulaC16H16FN
Molecular Weight241.31 g/mol
Exact Mass241.13
IUPAC Name2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine
SMILESNC(c1ccccc1F)C1Cc2ccccc2C1
InChIInChI=1S/C16H16FN/c17-15-8-4-3-7-14(15)16(18)13-9-11-5-1-2-6-12(11)10-13/h1-8,13,16H,9-10,18H2
InChIKeyDJOQSJYAQWKYID-UHFFFAOYSA-N
XLogP3.24
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,3-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
CID 65410517
(2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
CID 65410116
2,3-dihydro-1H-inden-2-yl-(2,3,4-trifluorophenyl)methanamine
CID 65410711
3-bicyclo[3.1.0]hexanyl-(2-fluorophenyl)methanamine
CID 115828090
(2-fluorophenyl)-(thian-4-yl)methanamine
CID 82391625
(2-fluorophenyl)-(oxan-4-yl)methanamine
CID 63934888
(5-bromo-2-fluorophenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 79743119
(2,4-difluoro-5-methylphenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126557
4-[amino-(2-fluorophenyl)methyl]cyclohexane-1-carboxylic acid
CID 116938812
2,3-dihydro-1H-inden-2-yl-(4-fluoro-3-methylphenyl)methanamine
CID 65411297
(3-bromo-2,6-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
CID 106942637
(2-chloro-4,5-dimethylphenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
CID 106892808

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine?
The IUPAC name of 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine (CID 65409529) is 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine.
What is the SMILES notation for 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine?
The canonical SMILES for 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine is NC(c1ccccc1F)C1Cc2ccccc2C1.
What is the InChIKey of 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine?
The InChIKey is DJOQSJYAQWKYID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN/c17-15-8-4-3-7-14(15)16(18)13-9-11-5-1-2-6-12(11)10-13/h1-8,13,16H,9-10,18H2.
What are the key properties of 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine?
2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine has a molecular weight of 241.31 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine is sourced from PubChem (CID 65409529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).