2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine

C16H19NOS — CID 115865080

IUPAC2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine
SMILESCOc1csc(C(N)Cc2ccc3c(c2)CCC3)c1
InChIInChI=1S/C16H19NOS/c1-18-14-9-16(19-10-14)15(17)8-11-5-6-12-3-2-4-13(12)7-11/h5-7,9-10,15H,2-4,8,17H2,1H3
InChIKeyRUAZDUGJPCEGPE-UHFFFAOYSA-N
MW273.40 g/mol
LogP3.49
Rot. Bonds4

About 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine

2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine (PubChem CID 115865080) has the molecular formula C16H19NOS and a molecular weight of 273.40 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine
PubChem CID115865080
Molecular FormulaC16H19NOS
Molecular Weight273.40 g/mol
Exact Mass273.12
IUPAC Name2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine
SMILESCOc1csc(C(N)Cc2ccc3c(c2)CCC3)c1
InChIInChI=1S/C16H19NOS/c1-18-14-9-16(19-10-14)15(17)8-11-5-6-12-3-2-4-13(12)7-11/h5-7,9-10,15H,2-4,8,17H2,1H3
InChIKeyRUAZDUGJPCEGPE-UHFFFAOYSA-N
XLogP3.49
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43198190
2-(2,6-dimethylphenyl)-1-(4-methoxythiophen-2-yl)ethanamine
CID 105024721
2-(5-ethyl-2-pyridinyl)-1-(4-methoxythiophen-2-yl)ethanamine
CID 105014765
1-(3-chlorothiophen-2-yl)-2-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 115865039
2-(2,3-dihydro-1H-inden-5-yl)-1-(3-methoxy-4-methylphenyl)ethanamine
CID 115864950
2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 115864890
1-(4-methoxythiophen-2-yl)-2-(2,4,6-trimethylphenyl)ethanamine
CID 115829185
1-(4-methoxythiophen-2-yl)pentan-1-amine
CID 115832999
2-(5-chloro-2-methoxyphenyl)-1-(4-methoxythiophen-2-yl)ethanamine
CID 115845063
1-(1-benzothiophen-3-yl)-2-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 115864884
2-(2,3-dihydro-1H-inden-5-yl)-1-(3,4-dimethylphenyl)ethanamine
CID 115864878
1-(2,3-dihydro-1H-inden-5-yl)-3-ethyl-3-methoxypentan-2-amine
CID 116760450

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine (CID 115865080) is 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine is COc1csc(C(N)Cc2ccc3c(c2)CCC3)c1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine?
The InChIKey is RUAZDUGJPCEGPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NOS/c1-18-14-9-16(19-10-14)15(17)8-11-5-6-12-3-2-4-13(12)7-11/h5-7,9-10,15H,2-4,8,17H2,1H3.
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine?
2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine has a molecular weight of 273.40 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yl)-1-(4-methoxythiophen-2-yl)ethanamine is sourced from PubChem (CID 115865080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).