1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine

C14H13NOS — CID 81154346

IUPAC1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine
SMILESCNC(c1ccco1)c1cccc2ccsc12
InChIInChI=1S/C14H13NOS/c1-15-13(12-6-3-8-16-12)11-5-2-4-10-7-9-17-14(10)11/h2-9,13,15H,1H3
InChIKeyZSXSYKNUYTWJEN-UHFFFAOYSA-N
MW243.33 g/mol
LogP3.80
Rot. Bonds3

About 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine

1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine (PubChem CID 81154346) has the molecular formula C14H13NOS and a molecular weight of 243.33 g/mol. Its IUPAC name is 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine
PubChem CID81154346
Molecular FormulaC14H13NOS
Molecular Weight243.33 g/mol
Exact Mass243.07
IUPAC Name1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine
SMILESCNC(c1ccco1)c1cccc2ccsc12
InChIInChI=1S/C14H13NOS/c1-15-13(12-6-3-8-16-12)11-5-2-4-10-7-9-17-14(10)11/h2-9,13,15H,1H3
InChIKeyZSXSYKNUYTWJEN-UHFFFAOYSA-N
XLogP3.80
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-benzothiophen-7-yl)-1-(2,3-dichlorophenyl)-N-methylmethanamine
CID 105021929
1-(1-benzothiophen-7-yl)-1-(4-iodophenyl)-N-methylmethanamine
CID 105021870
1-(1-benzothiophen-7-yl)-1-(2,5-dimethylfuran-3-yl)-N-methylmethanamine
CID 105021830
1-(1-benzothiophen-7-yl)-N-methyl-1-(3-methylphenyl)methanamine
CID 81153387
1-(1-benzothiophen-7-yl)-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 105021764
[1-benzothiophen-7-yl-(3-methylfuran-2-yl)methyl]hydrazine
CID 105269313
1-(2,3-difluorophenyl)-1-(furan-2-yl)-N-methylmethanamine
CID 62649885
1-(1-benzothiophen-7-yl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105172720
1-(1-benzothiophen-7-yl)-1-(2,5-dibromothiophen-3-yl)-N-methylmethanamine
CID 107968843
1-(1-benzothiophen-7-yl)-1-(1,3-dihydro-2-benzofuran-5-yl)-N-methylmethanamine
CID 105021849
1-(1-benzothiophen-7-yl)-1-(5-fluoro-2-methylphenyl)-N-methylmethanamine
CID 81152982
1-(1-benzothiophen-7-yl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 105021845

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine (CID 81154346) is 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine is CNC(c1ccco1)c1cccc2ccsc12.
What is the InChIKey of 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine?
The InChIKey is ZSXSYKNUYTWJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NOS/c1-15-13(12-6-3-8-16-12)11-5-2-4-10-7-9-17-14(10)11/h2-9,13,15H,1H3.
What are the key properties of 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine?
1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine has a molecular weight of 243.33 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzothiophen-7-yl)-1-(furan-2-yl)-N-methylmethanamine is sourced from PubChem (CID 81154346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).