1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

C18H23NS — CID 63508230

IUPAC1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
SMILESCNC(c1cc(C)sc1C)C1CCCc2ccccc21
InChIInChI=1S/C18H23NS/c1-12-11-17(13(2)20-12)18(19-3)16-10-6-8-14-7-4-5-9-15(14)16/h4-5,7,9,11,16,18-19H,6,8,10H2,1-3H3
InChIKeyIOWYXLOYIIXFGW-UHFFFAOYSA-N
MW285.46 g/mol
LogP4.75
Rot. Bonds3

About 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine (PubChem CID 63508230) has the molecular formula C18H23NS and a molecular weight of 285.46 g/mol. Its IUPAC name is 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine.

Molecular Properties

Compound Name1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
PubChem CID63508230
Molecular FormulaC18H23NS
Molecular Weight285.46 g/mol
Exact Mass285.16
IUPAC Name1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
SMILESCNC(c1cc(C)sc1C)C1CCCc2ccccc21
InChIInChI=1S/C18H23NS/c1-12-11-17(13(2)20-12)18(19-3)16-10-6-8-14-7-4-5-9-15(14)16/h4-5,7,9,11,16,18-19H,6,8,10H2,1-3H3
InChIKeyIOWYXLOYIIXFGW-UHFFFAOYSA-N
XLogP4.75
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.46
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine with MolForge

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Related Compounds

1-(2-fluorophenyl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63250536
N-methyl-1-(4-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 62718728
1-(2,5-dimethylthiophen-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)ethanamine
CID 63772960
1-(5-bromothiophen-2-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63503087
[(2-methylthiophen-3-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 102842760
N-methyl-1-pyrimidin-5-yl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63250535
1-(2-chlorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)-N-methylmethanamine
CID 65403390
[(3,5-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 105218933
[(5-fluoro-2-methylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 105218802
ethane;1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 144539733
1-(2,3-dichlorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)-N-methylmethanamine
CID 65406109
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079622

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The IUPAC name of 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine (CID 63508230) is 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine.
What is the SMILES notation for 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The canonical SMILES for 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine is CNC(c1cc(C)sc1C)C1CCCc2ccccc21.
What is the InChIKey of 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The InChIKey is IOWYXLOYIIXFGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NS/c1-12-11-17(13(2)20-12)18(19-3)16-10-6-8-14-7-4-5-9-15(14)16/h4-5,7,9,11,16,18-19H,6,8,10H2,1-3H3.
What are the key properties of 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine has a molecular weight of 285.46 g/mol, XLogP of 4.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylthiophen-3-yl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine is sourced from PubChem (CID 63508230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).