N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine

C14H19NOS — CID 62346411

IUPACN-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine
SMILESCCNC(c1ccc(CC)o1)c1sccc1C
InChIInChI=1S/C14H19NOS/c1-4-11-6-7-12(16-11)13(15-5-2)14-10(3)8-9-17-14/h6-9,13,15H,4-5H2,1-3H3
InChIKeyBSADBQDOEMWHNM-UHFFFAOYSA-N
MW249.38 g/mol
LogP3.91
Rot. Bonds5

About N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine

N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine (PubChem CID 62346411) has the molecular formula C14H19NOS and a molecular weight of 249.38 g/mol. Its IUPAC name is N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine
PubChem CID62346411
Molecular FormulaC14H19NOS
Molecular Weight249.38 g/mol
Exact Mass249.12
IUPAC NameN-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine
SMILESCCNC(c1ccc(CC)o1)c1sccc1C
InChIInChI=1S/C14H19NOS/c1-4-11-6-7-12(16-11)13(15-5-2)14-10(3)8-9-17-14/h6-9,13,15H,4-5H2,1-3H3
InChIKeyBSADBQDOEMWHNM-UHFFFAOYSA-N
XLogP3.91
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine with MolForge

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Related Compounds

1-(5-ethylfuran-2-yl)-N-methyl-1-(3-methylthiophen-2-yl)methanamine
CID 62345160
N-[(4,5-dimethylfuran-2-yl)-(5-ethylfuran-2-yl)methyl]ethanamine
CID 114249078
N-[(5-ethylfuran-2-yl)-(4-methylphenyl)methyl]ethanamine
CID 55061507
[(3-chlorothiophen-2-yl)-(5-ethylfuran-2-yl)methyl]hydrazine
CID 107362303
N-[(2,3-difluoro-4-methylphenyl)-(3-methylthiophen-2-yl)methyl]ethanamine
CID 107515906
N-[(5-bromo-2-methylphenyl)-(5-ethylfuran-2-yl)methyl]ethanamine
CID 65308243
N-[(4-bromo-2,5-dimethylphenyl)-(5-ethylfuran-2-yl)methyl]ethanamine
CID 79096339
N-[(4-chlorophenyl)-(5-ethylfuran-2-yl)methyl]ethanamine
CID 62346781
N-[(3-chloro-4-methylthiophen-2-yl)-[5-(methoxymethyl)furan-2-yl]methyl]ethanamine
CID 103401425
N-[(4-methoxyphenyl)-(3-methylthiophen-2-yl)methyl]ethanamine
CID 43489161
N-[(3,5-dimethylthiophen-2-yl)-(5-ethylfuran-2-yl)methyl]propan-1-amine
CID 81156942
N-[(4-methoxy-2,5-dimethylphenyl)-(3-methylthiophen-2-yl)methyl]ethanamine
CID 105032743

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine?
The IUPAC name of N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine (CID 62346411) is N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine?
The canonical SMILES for N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine is CCNC(c1ccc(CC)o1)c1sccc1C.
What is the InChIKey of N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine?
The InChIKey is BSADBQDOEMWHNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NOS/c1-4-11-6-7-12(16-11)13(15-5-2)14-10(3)8-9-17-14/h6-9,13,15H,4-5H2,1-3H3.
What are the key properties of N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine?
N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine has a molecular weight of 249.38 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethylfuran-2-yl)-(3-methylthiophen-2-yl)methyl]ethanamine is sourced from PubChem (CID 62346411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).