4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine

C11H15NO2 — CID 61382953

IUPAC4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine
SMILESCOc1cc(OC)c2c(c1)C(N)CC2
InChIInChI=1S/C11H15NO2/c1-13-7-5-9-8(3-4-10(9)12)11(6-7)14-2/h5-6,10H,3-4,12H2,1-2H3
InChIKeyBMMIJBKOOXDOQU-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.65
Rot. Bonds2

About 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine

4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine (PubChem CID 61382953) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine
PubChem CID61382953
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine
SMILESCOc1cc(OC)c2c(c1)C(N)CC2
InChIInChI=1S/C11H15NO2/c1-13-7-5-9-8(3-4-10(9)12)11(6-7)14-2/h5-6,10H,3-4,12H2,1-2H3
InChIKeyBMMIJBKOOXDOQU-UHFFFAOYSA-N
XLogP1.65
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-amino-6-methoxy-2,3-dihydro-1H-inden-4-ol
CID 130664492
1-bromo-4,6-dimethoxy-2,3-dihydro-1H-indene
CID 61384882
(1S)-4,5-difluoro-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 55272365
(5S)-1-chloro-3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 79014415
(5S)-1-fluoro-3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 79014491
(4aS,10bR)-7,9-dimethoxy-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline
CID 71412434
6-methoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 18627821
(6R)-1,3-dimethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-amine
CID 129392139
4-chloro-5-methoxy-2,3-dihydro-1H-inden-1-amine
CID 55272709
5,6,7-trimethoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 55109327
(1S)-4,6-dibromo-5-methoxy-2,3-dihydro-1H-inden-1-amine
CID 130706079
(1R)-5,6,7-trimethoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79014185

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine (CID 61382953) is 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine is COc1cc(OC)c2c(c1)C(N)CC2.
What is the InChIKey of 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine?
The InChIKey is BMMIJBKOOXDOQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-13-7-5-9-8(3-4-10(9)12)11(6-7)14-2/h5-6,10H,3-4,12H2,1-2H3.
What are the key properties of 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine?
4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine has a molecular weight of 193.25 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 61382953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).