(3,3-difluoro-1,2-dihydroinden-1-yl)methanamine

C10H11F2N — CID 83853608

IUPAC(3,3-difluoro-1,2-dihydroinden-1-yl)methanamine
SMILESNCC1CC(F)(F)c2ccccc21
InChIInChI=1S/C10H11F2N/c11-10(12)5-7(6-13)8-3-1-2-4-9(8)10/h1-4,7H,5-6,13H2
InChIKeyNFJHCCLTYSUSQW-UHFFFAOYSA-N
MW183.20 g/mol
LogP2.22
Rot. Bonds1

About (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine

(3,3-difluoro-1,2-dihydroinden-1-yl)methanamine (PubChem CID 83853608) has the molecular formula C10H11F2N and a molecular weight of 183.20 g/mol. Its IUPAC name is (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine.

Molecular Properties

Compound Name(3,3-difluoro-1,2-dihydroinden-1-yl)methanamine
PubChem CID83853608
Molecular FormulaC10H11F2N
Molecular Weight183.20 g/mol
Exact Mass183.09
IUPAC Name(3,3-difluoro-1,2-dihydroinden-1-yl)methanamine
SMILESNCC1CC(F)(F)c2ccccc21
InChIInChI=1S/C10H11F2N/c11-10(12)5-7(6-13)8-3-1-2-4-9(8)10/h1-4,7H,5-6,13H2
InChIKeyNFJHCCLTYSUSQW-UHFFFAOYSA-N
XLogP2.22
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.20
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

spiro[1,2-dihydroindene-3,1'-cyclopropane]-1-ylmethanamine
CID 83752617
(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)methanamine
CID 43316841
3,3-difluoro-1,2-dihydroindene-1-carboxylic acid
CID 83853596
(4-fluorospiro[1,2-dihydroindene-3,1'-cyclopropane]-1-yl)methanamine
CID 83753060
(1S)-1-ethyl-3,3-dimethyl-1,2-dihydroindene
CID 149388783
[(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine
CID 58681536
3-amino-2,3-dihydroindene-1,1-diol
CID 70048051
5,5-difluoro-1-methyl-3,4-dihydro-1H-2-benzoxepine
CID 165409714
1-(4,4-difluoro-1,3-dihydroisochromen-1-yl)-N-methylmethanamine
CID 134208098
4-(aminomethyl)-2,2-dimethyl-3,4-dihydrochromen-8-ol
CID 84675315
[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887493
[(4S)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887495

Frequently Asked Questions

What is the IUPAC name of (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine?
The IUPAC name of (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine (CID 83853608) is (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine.
What is the SMILES notation for (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine?
The canonical SMILES for (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine is NCC1CC(F)(F)c2ccccc21.
What is the InChIKey of (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine?
The InChIKey is NFJHCCLTYSUSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2N/c11-10(12)5-7(6-13)8-3-1-2-4-9(8)10/h1-4,7H,5-6,13H2.
What are the key properties of (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine?
(3,3-difluoro-1,2-dihydroinden-1-yl)methanamine has a molecular weight of 183.20 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-difluoro-1,2-dihydroinden-1-yl)methanamine is sourced from PubChem (CID 83853608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).