[6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine

C11H17NOS — CID 130583755

IUPAC[6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine
SMILESCc1ccc(C2CCCC(CN)O2)s1
InChIInChI=1S/C11H17NOS/c1-8-5-6-11(14-8)10-4-2-3-9(7-12)13-10/h5-6,9-10H,2-4,7,12H2,1H3
InChIKeySJCILAAZYQZIJA-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.63
Rot. Bonds2

About [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine

[6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine (PubChem CID 130583755) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine.

Molecular Properties

Compound Name[6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine
PubChem CID130583755
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name[6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine
SMILESCc1ccc(C2CCCC(CN)O2)s1
InChIInChI=1S/C11H17NOS/c1-8-5-6-11(14-8)10-4-2-3-9(7-12)13-10/h5-6,9-10H,2-4,7,12H2,1H3
InChIKeySJCILAAZYQZIJA-UHFFFAOYSA-N
XLogP2.63
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine 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

5-(5-methylthiophen-2-yl)oxolane-2-carboxylic acid
CID 130585100
[(2S,3R)-1-methyl-2-(5-methylthiophen-2-yl)piperidin-3-yl]methanamine
CID 95328752
[1-[(5-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]methanamine
CID 115311784
2-[2-(5-methylthiophen-2-yl)-1,3-dioxolan-4-yl]ethanol
CID 117169327
2-(5-methylthiophen-2-yl)-1,3-dioxolane
CID 55255317
[2-(5-methylthiophen-2-yl)-1,3-dioxolan-4-yl]methanol
CID 115094617
(2S,4S)-4-(chloromethyl)-2-(5-methylthiophen-2-yl)-1,3-dioxolane
CID 97301275
4-ethyl-2-(5-methylthiophen-2-yl)morpholine
CID 174485683
[(2S)-6-[3-(trifluoromethyl)phenyl]oxan-2-yl]methanamine
CID 134408200
[5-(1,3-dimethylpyrazol-4-yl)oxolan-2-yl]methanamine
CID 130583637
(3S)-2-methyl-3-(5-methylthiophen-2-yl)-1,2-oxazolidine
CID 170000965
[4-ethyl-2-(5-methylthiophen-2-yl)cyclohexyl]methanamine
CID 81011696

Frequently Asked Questions

What is the IUPAC name of [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine?
The IUPAC name of [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine (CID 130583755) is [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine.
What is the SMILES notation for [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine?
The canonical SMILES for [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine is Cc1ccc(C2CCCC(CN)O2)s1.
What is the InChIKey of [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine?
The InChIKey is SJCILAAZYQZIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-8-5-6-11(14-8)10-4-2-3-9(7-12)13-10/h5-6,9-10H,2-4,7,12H2,1H3.
What are the key properties of [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine?
[6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine has a molecular weight of 211.33 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine is sourced from PubChem (CID 130583755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).