N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine

C14H13NOS — CID 28669225

IUPACN-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine
SMILESc1csc(CNCc2cc3ccccc3o2)c1
InChIInChI=1S/C14H13NOS/c1-2-6-14-11(4-1)8-12(16-14)9-15-10-13-5-3-7-17-13/h1-8,15H,9-10H2
InChIKeyBZNYLSWJRGZZKF-UHFFFAOYSA-N
MW243.33 g/mol
LogP3.78
Rot. Bonds4

About N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine

N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine (PubChem CID 28669225) has the molecular formula C14H13NOS and a molecular weight of 243.33 g/mol. Its IUPAC name is N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine.

Molecular Properties

Compound NameN-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine
PubChem CID28669225
Molecular FormulaC14H13NOS
Molecular Weight243.33 g/mol
Exact Mass243.07
IUPAC NameN-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine
SMILESc1csc(CNCc2cc3ccccc3o2)c1
InChIInChI=1S/C14H13NOS/c1-2-6-14-11(4-1)8-12(16-14)9-15-10-13-5-3-7-17-13/h1-8,15H,9-10H2
InChIKeyBZNYLSWJRGZZKF-UHFFFAOYSA-N
XLogP3.78
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(1-benzofuran-2-yl)ethyl]-3-(thiophen-2-ylmethyl)urea
CID 166212107
N-[[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]-1-thiophen-2-ylmethanamine
CID 47611099
1-(1-benzofuran-2-yl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]methanamine
CID 55172060
1-(1-benzofuran-2-yl)-N-(1,3-benzothiazol-2-ylmethyl)methanamine
CID 28665559
1-naphthalen-1-yl-N-(thiophen-2-ylmethyl)methanamine;hydrochloride
CID 17289837
N-(1-benzofuran-2-ylmethyl)-2-ethylsulfinylethanamine
CID 113237590
N-(1-benzofuran-2-ylmethyl)-2,3,3-trimethylbutan-1-amine
CID 78966709
N-(1-benzofuran-2-ylmethyl)-N',N'-dimethylpropane-1,3-diamine
CID 28618146
N-(1-benzofuran-2-ylmethyl)-N',N'-diethylethane-1,2-diamine
CID 28615423
2-(1-benzofuran-2-ylmethoxymethyl)-1-benzofuran
CID 151118650
1-[2-(1-benzofuran-2-yl)ethyl]-2-(2-thiophen-2-ylethyl)guanidine
CID 111818046
CID 156725408
CID 156725408

Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine?
The IUPAC name of N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine (CID 28669225) is N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine.
What is the SMILES notation for N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine?
The canonical SMILES for N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine is c1csc(CNCc2cc3ccccc3o2)c1.
What is the InChIKey of N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine?
The InChIKey is BZNYLSWJRGZZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NOS/c1-2-6-14-11(4-1)8-12(16-14)9-15-10-13-5-3-7-17-13/h1-8,15H,9-10H2.
What are the key properties of N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine?
N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine has a molecular weight of 243.33 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-2-ylmethyl)-1-thiophen-2-ylmethanamine is sourced from PubChem (CID 28669225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).