(1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine

C10H12FN — CID 130739092

IUPAC(1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCc1cc(F)cc2c1[C@@H](N)CC2
InChIInChI=1S/C10H12FN/c1-6-4-8(11)5-7-2-3-9(12)10(6)7/h4-5,9H,2-3,12H2,1H3/t9-/m0/s1
InChIKeyPMLQYFOBALBJKD-VIFPVBQESA-N
MW165.21 g/mol
LogP2.08
Rot. Bonds

About (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine

(1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 130739092) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name(1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine
PubChem CID130739092
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name(1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCc1cc(F)cc2c1[C@@H](N)CC2
InChIInChI=1S/C10H12FN/c1-6-4-8(11)5-7-2-3-9(12)10(6)7/h4-5,9H,2-3,12H2,1H3/t9-/m0/s1
InChIKeyPMLQYFOBALBJKD-VIFPVBQESA-N
XLogP2.08
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-chloro-7-methyl-2,3-dihydro-1H-inden-1-amine
CID 91618885
(1R)-5-methoxy-7-methyl-2,3-dihydro-1H-inden-1-amine
CID 130682288
5-fluoro-7-methyl-1-(sulfamoylamino)-2,3-dihydro-1H-indene
CID 72706663
6,8-difluoro-1,2,3,4-tetrahydronaphthalen-1-amine
CID 55253125
6-fluoro-8-methylspiro[2,3-dihydro-1H-naphthalene-4,1'-cyclobutane]-1-amine
CID 165484043
(1R)-6-chloro-8-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130624873
2,2,5-trifluoro-7-methyl-1,3-dihydroinden-1-amine
CID 91619096
6-fluoro-5-methyl-2,3-dihydro-1H-inden-1-amine
CID 55294363
(5,7-difluoro-2,3-dihydro-1H-inden-1-yl)methanamine
CID 84768946
5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 16666328
7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine
CID 68632948
(1R)-7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine
CID 130713773

Frequently Asked Questions

What is the IUPAC name of (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine (CID 130739092) is (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine is Cc1cc(F)cc2c1[C@@H](N)CC2.
What is the InChIKey of (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is PMLQYFOBALBJKD-VIFPVBQESA-N. The full InChI is InChI=1S/C10H12FN/c1-6-4-8(11)5-7-2-3-9(12)10(6)7/h4-5,9H,2-3,12H2,1H3/t9-/m0/s1.
What are the key properties of (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine?
(1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 165.21 g/mol, XLogP of 2.08, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-5-fluoro-7-methyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 130739092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).