5,7-dimethoxy-1H-inden-1-amine

C11H13NO2 — CID 82158129

IUPAC5,7-dimethoxy-1H-inden-1-amine
SMILESCOc1cc2c(c(OC)c1)C(N)C=C2
InChIInChI=1S/C11H13NO2/c1-13-8-5-7-3-4-9(12)11(7)10(6-8)14-2/h3-6,9H,12H2,1-2H3
InChIKeyJXIRHVRIYCKXHU-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.73
Rot. Bonds2

About 5,7-dimethoxy-1H-inden-1-amine

5,7-dimethoxy-1H-inden-1-amine (PubChem CID 82158129) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 5,7-dimethoxy-1H-inden-1-amine.

Molecular Properties

Compound Name5,7-dimethoxy-1H-inden-1-amine
PubChem CID82158129
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name5,7-dimethoxy-1H-inden-1-amine
SMILESCOc1cc2c(c(OC)c1)C(N)C=C2
InChIInChI=1S/C11H13NO2/c1-13-8-5-7-3-4-9(12)11(7)10(6-8)14-2/h3-6,9H,12H2,1-2H3
InChIKeyJXIRHVRIYCKXHU-UHFFFAOYSA-N
XLogP1.73
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[(1R,2R)-2-(2,4,6-trimethoxyphenyl)cyclopropyl]ethanamine
CID 124552560
3-[(2,4,6-trimethoxyphenyl)methyl]cyclobutan-1-amine
CID 116926490
3-amino-5,7-dimethoxy-2,3-dihydro-1H-indene-1-carboxylic acid
CID 82159256
2,4,6,8-tetramethoxy-5-(2,4,6-trimethoxyphenyl)-5H-benzo[d][1,3]benzodioxocine
CID 70993959
5-(2,4,6-trimethoxyphenyl)-2,5-dihydro-1,2-oxazole
CID 91802885
(2R)-2-(2,4,6-trimethoxyphenyl)azetidine
CID 171197166
(4R)-5,7-dimethoxy-3,4-dihydro-2H-chromen-4-amine;hydrochloride
CID 171252301
1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene
CID 102287735
6-methoxy-1,2-dihydronaphthalen-2-amine
CID 45091183
(5S)-6,8-dimethoxy-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 79014321
trans-(1S,2R)-2-(2,4-dimethoxyphenyl)cyclopropan-1-amine
CID 39238725
3-(2-aminoethyl)-5,7-dimethoxy-2,3-dihydro-1H-inden-1-ol
CID 82159287

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethoxy-1H-inden-1-amine?
The IUPAC name of 5,7-dimethoxy-1H-inden-1-amine (CID 82158129) is 5,7-dimethoxy-1H-inden-1-amine.
What is the SMILES notation for 5,7-dimethoxy-1H-inden-1-amine?
The canonical SMILES for 5,7-dimethoxy-1H-inden-1-amine is COc1cc2c(c(OC)c1)C(N)C=C2.
What is the InChIKey of 5,7-dimethoxy-1H-inden-1-amine?
The InChIKey is JXIRHVRIYCKXHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-13-8-5-7-3-4-9(12)11(7)10(6-8)14-2/h3-6,9H,12H2,1-2H3.
What are the key properties of 5,7-dimethoxy-1H-inden-1-amine?
5,7-dimethoxy-1H-inden-1-amine has a molecular weight of 191.23 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethoxy-1H-inden-1-amine is sourced from PubChem (CID 82158129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).