1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine

C15H19NOS — CID 43480803

IUPAC1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine
SMILESCCc1ccc(C(NC)c2ccc(OC)cc2)s1
InChIInChI=1S/C15H19NOS/c1-4-13-9-10-14(18-13)15(16-2)11-5-7-12(17-3)8-6-11/h5-10,15-16H,4H2,1-3H3
InChIKeyHFBSEYYTSVJKBY-UHFFFAOYSA-N
MW261.39 g/mol
LogP3.63
Rot. Bonds5

About 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine

1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine (PubChem CID 43480803) has the molecular formula C15H19NOS and a molecular weight of 261.39 g/mol. Its IUPAC name is 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine
PubChem CID43480803
Molecular FormulaC15H19NOS
Molecular Weight261.39 g/mol
Exact Mass261.12
IUPAC Name1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine
SMILESCCc1ccc(C(NC)c2ccc(OC)cc2)s1
InChIInChI=1S/C15H19NOS/c1-4-13-9-10-14(18-13)15(16-2)11-5-7-12(17-3)8-6-11/h5-10,15-16H,4H2,1-3H3
InChIKeyHFBSEYYTSVJKBY-UHFFFAOYSA-N
XLogP3.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-ethylthiophen-2-yl)-1-(3-methoxyphenyl)-N-methylmethanamine
CID 43480785
N-[1-(5-ethylthiophen-2-yl)ethyl]-1-(4-methoxyphenyl)ethanamine
CID 66241993
1-(4-cyclobutylphenyl)-1-(5-ethylthiophen-2-yl)-N-methylmethanamine
CID 105044930
1-(5-ethylthiophen-2-yl)-1-(3-methoxythiophen-2-yl)-N-methylmethanamine
CID 81127074
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 61332919
1-(5-ethylthiophen-2-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylmethanamine
CID 105047071
1-(5-ethylthiophen-2-yl)-N-[(4-methoxyphenyl)methyl]ethanamine
CID 61334131
1-(5-bromo-3-pyridinyl)-1-(5-ethylthiophen-2-yl)-N-methylmethanamine
CID 43480738
1-(4-methoxyphenyl)-N-methyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
CID 106782941
[(5-ethylthiophen-2-yl)-(4-fluorophenyl)methyl]hydrazine
CID 105284022
N-[(4-bromophenyl)-(5-ethylthiophen-2-yl)methyl]ethanamine
CID 43488443
1-(5-ethylthiophen-2-yl)-N-methyl-1-[3-(trifluoromethyl)phenyl]methanamine
CID 43480838

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine (CID 43480803) is 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine is CCc1ccc(C(NC)c2ccc(OC)cc2)s1.
What is the InChIKey of 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The InChIKey is HFBSEYYTSVJKBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NOS/c1-4-13-9-10-14(18-13)15(16-2)11-5-7-12(17-3)8-6-11/h5-10,15-16H,4H2,1-3H3.
What are the key properties of 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine?
1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine has a molecular weight of 261.39 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 43480803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).