(2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine

C16H15F2N — CID 65410116

IUPAC(2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
SMILESNC(c1cc(F)ccc1F)C1Cc2ccccc2C1
InChIInChI=1S/C16H15F2N/c17-13-5-6-15(18)14(9-13)16(19)12-7-10-3-1-2-4-11(10)8-12/h1-6,9,12,16H,7-8,19H2
InChIKeyLDQSXIUKLQYISH-UHFFFAOYSA-N
MW259.30 g/mol
LogP3.38
Rot. Bonds2

About (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine

(2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine (PubChem CID 65410116) has the molecular formula C16H15F2N and a molecular weight of 259.30 g/mol. Its IUPAC name is (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine.

Molecular Properties

Compound Name(2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
PubChem CID65410116
Molecular FormulaC16H15F2N
Molecular Weight259.30 g/mol
Exact Mass259.12
IUPAC Name(2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
SMILESNC(c1cc(F)ccc1F)C1Cc2ccccc2C1
InChIInChI=1S/C16H15F2N/c17-13-5-6-15(18)14(9-13)16(19)12-7-10-3-1-2-4-11(10)8-12/h1-6,9,12,16H,7-8,19H2
InChIKeyLDQSXIUKLQYISH-UHFFFAOYSA-N
XLogP3.38
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dihydro-1H-inden-2-yl-(2-fluorophenyl)methanamine
CID 65409529
2,3-dihydro-1H-inden-2-yl-(2,3,4-trifluorophenyl)methanamine
CID 65410711
(5-bromo-2-fluorophenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 79743119
(2,3-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
CID 65410517
(2,5-difluorophenyl)-piperidin-4-ylmethanamine
CID 82287809
(R)-(2,5-difluorophenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314322
(2,4-difluoro-5-methylphenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126557
2,3-dihydro-1H-inden-2-yl-(4-fluoro-3-methylphenyl)methanamine
CID 65411297
1-(2,4-difluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
CID 65411306
(3-bromo-2,6-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine
CID 106942637
(2,5-difluorophenyl)-[3-(trifluoromethyl)cyclohexyl]methanamine
CID 105143945
(4-butylcyclohexyl)-(2,5-difluorophenyl)methanamine
CID 43100104

Frequently Asked Questions

What is the IUPAC name of (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine?
The IUPAC name of (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine (CID 65410116) is (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine.
What is the SMILES notation for (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine?
The canonical SMILES for (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine is NC(c1cc(F)ccc1F)C1Cc2ccccc2C1.
What is the InChIKey of (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine?
The InChIKey is LDQSXIUKLQYISH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2N/c17-13-5-6-15(18)14(9-13)16(19)12-7-10-3-1-2-4-11(10)8-12/h1-6,9,12,16H,7-8,19H2.
What are the key properties of (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine?
(2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine has a molecular weight of 259.30 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-difluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanamine is sourced from PubChem (CID 65410116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).