6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine

C15H21NO3S — CID 107758435

IUPAC6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine
SMILESCOc1ccc2c(c1)C(N)C(S(=O)C1CCOC1C)C2
InChIInChI=1S/C15H21NO3S/c1-9-13(5-6-19-9)20(17)14-7-10-3-4-11(18-2)8-12(10)15(14)16/h3-4,8-9,13-15H,5-7,16H2,1-2H3
InChIKeyGYUKLIZSGYISFG-UHFFFAOYSA-N
MW295.40 g/mol
LogP1.55
Rot. Bonds3

About 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine

6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 107758435) has the molecular formula C15H21NO3S and a molecular weight of 295.40 g/mol. Its IUPAC name is 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine
PubChem CID107758435
Molecular FormulaC15H21NO3S
Molecular Weight295.40 g/mol
Exact Mass295.12
IUPAC Name6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine
SMILESCOc1ccc2c(c1)C(N)C(S(=O)C1CCOC1C)C2
InChIInChI=1S/C15H21NO3S/c1-9-13(5-6-19-9)20(17)14-7-10-3-4-11(18-2)8-12(10)15(14)16/h3-4,8-9,13-15H,5-7,16H2,1-2H3
InChIKeyGYUKLIZSGYISFG-UHFFFAOYSA-N
XLogP1.55
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.40
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethylsulfinyl-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79368756
2-(2-chlorophenyl)sulfinyl-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79369081
6-methoxy-2-(oxan-4-ylsulfonyl)-2,3-dihydro-1H-inden-1-amine
CID 79369074
6-methoxy-2-(oxan-4-ylsulfinyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64654435
2-ethylsulfonyl-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79374666
6-methoxy-2-(3-methylmorpholin-4-yl)-2,3-dihydro-1H-inden-1-amine
CID 79375025
6-methoxy-2-N-methyl-2-N-(4-methylcyclohexyl)-2,3-dihydro-1H-indene-1,2-diamine
CID 79370662
(1R,2S)-2,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 66798065
2-cyclohexylsulfinyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64656390
6-methoxy-2-(3-methylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine
CID 79374892
4-methoxy-2-methyl-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-amine
CID 81422141
2-N-cyclohexyl-6-methoxy-2-N-methyl-2,3-dihydro-1H-indene-1,2-diamine
CID 79374538

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine (CID 107758435) is 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine is COc1ccc2c(c1)C(N)C(S(=O)C1CCOC1C)C2.
What is the InChIKey of 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is GYUKLIZSGYISFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3S/c1-9-13(5-6-19-9)20(17)14-7-10-3-4-11(18-2)8-12(10)15(14)16/h3-4,8-9,13-15H,5-7,16H2,1-2H3.
What are the key properties of 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine?
6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 295.40 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-(2-methyloxolan-3-yl)sulfinyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 107758435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).