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

C10H12FN — CID 83853754

IUPAC(3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine
SMILESNCc1ccc2c(c1)C(F)CC2
InChIInChI=1S/C10H12FN/c11-10-4-3-8-2-1-7(6-12)5-9(8)10/h1-2,5,10H,3-4,6,12H2
InChIKeyQEHDKQNWDMSSSD-UHFFFAOYSA-N
MW165.21 g/mol
LogP2.10
Rot. Bonds1

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

(3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine (PubChem CID 83853754) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine.

Molecular Properties

Compound Name(3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine
PubChem CID83853754
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name(3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine
SMILESNCc1ccc2c(c1)C(F)CC2
InChIInChI=1S/C10H12FN/c11-10-4-3-8-2-1-7(6-12)5-9(8)10/h1-2,5,10H,3-4,6,12H2
InChIKeyQEHDKQNWDMSSSD-UHFFFAOYSA-N
XLogP2.10
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-chloro-1-fluoro-2,3-dihydro-1H-indene
CID 84717388
5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol
CID 53439054
3-amino-4-[[6-(aminomethyl)-2,3-dihydro-1H-inden-1-yl]amino]cyclobut-3-ene-1,2-dione
CID 58686211
5,6,7,8-tetrahydronaphthalen-2-ylmethanamine;hydrochloride
CID 18993882
(1R)-6-ethyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 131884185
6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine
CID 57039214
(6-fluoro-2,3-dihydro-1H-inden-1-yl)methanamine
CID 82074741
4-(aminomethyl)-2-cyclopropylbenzonitrile
CID 177223075
1-(3-methyl-2,3-dihydro-1H-inden-5-yl)propan-2-amine
CID 117281618
(1S)-7-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 21104537
(4-cyclopropyl-3-methylphenyl)methanamine
CID 66479429
2-[(1R)-7-ethyl-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamine
CID 67627169

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine?
The IUPAC name of (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine (CID 83853754) is (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine.
What is the SMILES notation for (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine?
The canonical SMILES for (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine is NCc1ccc2c(c1)C(F)CC2.
What is the InChIKey of (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine?
The InChIKey is QEHDKQNWDMSSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN/c11-10-4-3-8-2-1-7(6-12)5-9(8)10/h1-2,5,10H,3-4,6,12H2.
What are the key properties of (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine?
(3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine has a molecular weight of 165.21 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-2,3-dihydro-1H-inden-5-yl)methanamine is sourced from PubChem (CID 83853754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).