(1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine

C10H12BrN — CID 130673475

IUPAC(1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCc1cc(Br)c2c(c1)[C@H](N)CC2
InChIInChI=1S/C10H12BrN/c1-6-4-8-7(9(11)5-6)2-3-10(8)12/h4-5,10H,2-3,12H2,1H3/t10-/m1/s1
InChIKeyZTVOBQOGJGGIJZ-SNVBAGLBSA-N
MW226.12 g/mol
LogP2.70
Rot. Bonds

About (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine

(1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 130673475) has the molecular formula C10H12BrN and a molecular weight of 226.12 g/mol. Its IUPAC name is (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name(1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine
PubChem CID130673475
Molecular FormulaC10H12BrN
Molecular Weight226.12 g/mol
Exact Mass225.02
IUPAC Name(1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCc1cc(Br)c2c(c1)[C@H](N)CC2
InChIInChI=1S/C10H12BrN/c1-6-4-8-7(9(11)5-6)2-3-10(8)12/h4-5,10H,2-3,12H2,1H3/t10-/m1/s1
InChIKeyZTVOBQOGJGGIJZ-SNVBAGLBSA-N
XLogP2.70
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.12
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 167722097
4,6-dibromo-2,3-dihydro-1H-indene-1,5-diamine
CID 58962980
(7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine
CID 97298159
(1S)-4,6-dibromo-5-methoxy-2,3-dihydro-1H-inden-1-amine
CID 130706079
(1S)-5-bromo-4-methyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 131887016
(1S)-5-iodo-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130624371
(8R)-8-amino-4-bromo-5,6,7,8-tetrahydronaphthalen-2-ol
CID 130826617
(1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine
CID 55275438
(1R)-6-bromo-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 66799240
8-bromo-2,2,6-trimethyl-3,4-dihydrochromen-4-amine
CID 64696649
(1R)-4-fluoro-5-methyl-2,3-dihydro-1H-indene-1,6-diamine
CID 55274698
(1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine
CID 55275275

Frequently Asked Questions

What is the IUPAC name of (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine (CID 130673475) is (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine is Cc1cc(Br)c2c(c1)[C@H](N)CC2.
What is the InChIKey of (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is ZTVOBQOGJGGIJZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H12BrN/c1-6-4-8-7(9(11)5-6)2-3-10(8)12/h4-5,10H,2-3,12H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine?
(1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 226.12 g/mol, XLogP of 2.70, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-4-bromo-6-methyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 130673475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).