N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine

C14H19NOS — CID 55061752

IUPACN-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine
SMILESCCCNC(c1ccsc1)c1ccc(CC)o1
InChIInChI=1S/C14H19NOS/c1-3-8-15-14(11-7-9-17-10-11)13-6-5-12(4-2)16-13/h5-7,9-10,14-15H,3-4,8H2,1-2H3
InChIKeyGKHUTFWUMSQNJL-UHFFFAOYSA-N
MW249.38 g/mol
LogP3.99
Rot. Bonds6

About N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine

N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine (PubChem CID 55061752) has the molecular formula C14H19NOS and a molecular weight of 249.38 g/mol. Its IUPAC name is N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine.

Molecular Properties

Compound NameN-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine
PubChem CID55061752
Molecular FormulaC14H19NOS
Molecular Weight249.38 g/mol
Exact Mass249.12
IUPAC NameN-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine
SMILESCCCNC(c1ccsc1)c1ccc(CC)o1
InChIInChI=1S/C14H19NOS/c1-3-8-15-14(11-7-9-17-10-11)13-6-5-12(4-2)16-13/h5-7,9-10,14-15H,3-4,8H2,1-2H3
InChIKeyGKHUTFWUMSQNJL-UHFFFAOYSA-N
XLogP3.99
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-ethylfuran-2-yl)-N-methyl-1-thiophen-3-ylmethanamine
CID 62345338
N-[(5-ethylthiophen-2-yl)-thiophen-3-ylmethyl]propan-1-amine
CID 43494287
(S)-(5-ethylfuran-2-yl)-thiophen-3-ylmethanamine
CID 94398939
N-[(5-ethylfuran-2-yl)-(4-fluoro-3-methylphenyl)methyl]propan-1-amine
CID 63210049
N-[(5-methylthiophen-3-yl)-thiophen-3-ylmethyl]propan-1-amine
CID 65104445
N-[(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methyl]propan-1-amine
CID 115861459
N-[(3-chlorothiophen-2-yl)-thiophen-3-ylmethyl]propan-1-amine
CID 80529345
N-[(2-bromofuran-3-yl)-thiophen-3-ylmethyl]propan-1-amine
CID 106857785
N-[(3,5-dimethylthiophen-2-yl)-(5-ethylfuran-2-yl)methyl]propan-1-amine
CID 81156942
N-[(3-methoxy-4-methylphenyl)-thiophen-3-ylmethyl]propan-1-amine
CID 104988346
N-[1-benzothiophen-7-yl-(5-ethylfuran-2-yl)methyl]propan-1-amine
CID 105021891
N-[(2-fluoro-3-methoxyphenyl)-thiophen-3-ylmethyl]propan-1-amine
CID 82808330

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine?
The IUPAC name of N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine (CID 55061752) is N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine.
What is the SMILES notation for N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine?
The canonical SMILES for N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine is CCCNC(c1ccsc1)c1ccc(CC)o1.
What is the InChIKey of N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine?
The InChIKey is GKHUTFWUMSQNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NOS/c1-3-8-15-14(11-7-9-17-10-11)13-6-5-12(4-2)16-13/h5-7,9-10,14-15H,3-4,8H2,1-2H3.
What are the key properties of N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine?
N-[(5-ethylfuran-2-yl)-thiophen-3-ylmethyl]propan-1-amine has a molecular weight of 249.38 g/mol, XLogP of 3.99, 6 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)-thiophen-3-ylmethyl]propan-1-amine is sourced from PubChem (CID 55061752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).