N-methyl-1-(5-phenylthiophen-2-yl)ethanamine

C13H15NS — CID 43288011

IUPACN-methyl-1-(5-phenylthiophen-2-yl)ethanamine
SMILESCNC(C)c1ccc(-c2ccccc2)s1
InChIInChI=1S/C13H15NS/c1-10(14-2)12-8-9-13(15-12)11-6-4-3-5-7-11/h3-10,14H,1-2H3
InChIKeyQSTZPWZVMZQOIW-UHFFFAOYSA-N
MW217.34 g/mol
LogP3.70
Rot. Bonds3

About N-methyl-1-(5-phenylthiophen-2-yl)ethanamine

N-methyl-1-(5-phenylthiophen-2-yl)ethanamine (PubChem CID 43288011) has the molecular formula C13H15NS and a molecular weight of 217.34 g/mol. Its IUPAC name is N-methyl-1-(5-phenylthiophen-2-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(5-phenylthiophen-2-yl)ethanamine
PubChem CID43288011
Molecular FormulaC13H15NS
Molecular Weight217.34 g/mol
Exact Mass217.09
IUPAC NameN-methyl-1-(5-phenylthiophen-2-yl)ethanamine
SMILESCNC(C)c1ccc(-c2ccccc2)s1
InChIInChI=1S/C13H15NS/c1-10(14-2)12-8-9-13(15-12)11-6-4-3-5-7-11/h3-10,14H,1-2H3
InChIKeyQSTZPWZVMZQOIW-UHFFFAOYSA-N
XLogP3.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(3,4-dimethylphenyl)thiophen-2-yl]-N-methylethanamine
CID 43287906
(1R)-N-methyl-1-(5-thiophen-2-ylthiophen-2-yl)ethanamine
CID 96704192
1-[5-(4-bromo-3-fluorophenyl)thiophen-2-yl]-N-methylethanamine
CID 65437979
4-chloro-N-[(1S)-1-(5-phenylthiophen-2-yl)ethyl]pyrimidin-2-amine
CID 141420637
N-methyl-1-[5-(2,4,5-trifluorophenyl)thiophen-2-yl]ethanamine
CID 62810581
N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine
CID 43288007
N-methyl-1-[5-(1-propan-2-ylpyrazol-3-yl)thiophen-2-yl]ethanamine
CID 114251064
1-(5-phenylthiophen-2-yl)ethane-1,2-diamine
CID 170894587
1-[5-(2-chloro-5-fluorophenyl)thiophen-2-yl]-N-methylethanamine
CID 107530688
(1R)-1-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 55277214
1-[5-(2-chloro-4-iodophenyl)thiophen-2-yl]-N-methylethanamine
CID 107607471
1-[5-(2-bromo-5-chlorophenyl)thiophen-2-yl]-N-methylethanamine
CID 81275271

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-phenylthiophen-2-yl)ethanamine?
The IUPAC name of N-methyl-1-(5-phenylthiophen-2-yl)ethanamine (CID 43288011) is N-methyl-1-(5-phenylthiophen-2-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(5-phenylthiophen-2-yl)ethanamine?
The canonical SMILES for N-methyl-1-(5-phenylthiophen-2-yl)ethanamine is CNC(C)c1ccc(-c2ccccc2)s1.
What is the InChIKey of N-methyl-1-(5-phenylthiophen-2-yl)ethanamine?
The InChIKey is QSTZPWZVMZQOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NS/c1-10(14-2)12-8-9-13(15-12)11-6-4-3-5-7-11/h3-10,14H,1-2H3.
What are the key properties of N-methyl-1-(5-phenylthiophen-2-yl)ethanamine?
N-methyl-1-(5-phenylthiophen-2-yl)ethanamine has a molecular weight of 217.34 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-phenylthiophen-2-yl)ethanamine is sourced from PubChem (CID 43288011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).