1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine

C12H14ClNOS — CID 106687804

IUPAC1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine
SMILESCCNC(Cc1cccs1)c1ccc(Cl)o1
InChIInChI=1S/C12H14ClNOS/c1-2-14-10(8-9-4-3-7-16-9)11-5-6-12(13)15-11/h3-7,10,14H,2,8H2,1H3
InChIKeyIECJYLUOGQQBFA-UHFFFAOYSA-N
MW255.77 g/mol
LogP3.89
Rot. Bonds5

About 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine

1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine (PubChem CID 106687804) has the molecular formula C12H14ClNOS and a molecular weight of 255.77 g/mol. Its IUPAC name is 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine.

Molecular Properties

Compound Name1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine
PubChem CID106687804
Molecular FormulaC12H14ClNOS
Molecular Weight255.77 g/mol
Exact Mass255.05
IUPAC Name1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine
SMILESCCNC(Cc1cccs1)c1ccc(Cl)o1
InChIInChI=1S/C12H14ClNOS/c1-2-14-10(8-9-4-3-7-16-9)11-5-6-12(13)15-11/h3-7,10,14H,2,8H2,1H3
InChIKeyIECJYLUOGQQBFA-UHFFFAOYSA-N
XLogP3.89
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.77
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-chlorofuran-2-yl)-N-ethylpropan-1-amine
CID 106691408
N-ethyl-1,2-dithiophen-2-ylethanamine
CID 43755169
2-(1-bromo-2-thiophen-2-ylethyl)-5-chlorofuran
CID 106689781
1-(2-chloro-3-fluorophenyl)-N-ethyl-2-thiophen-2-ylethanamine
CID 81453728
1-(3-chloro-4-methylphenyl)-N-ethyl-2-thiophen-2-ylethanamine
CID 63195285
N-ethyl-1-pyrimidin-5-yl-2-thiophen-2-ylethanamine
CID 62501356
1-(5-chlorofuran-2-yl)-N-ethyl-2-(2-methoxyphenyl)ethanamine
CID 106687833
1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine
CID 106693011
N-ethyl-3-(thiophen-2-ylmethyl)pentan-2-amine
CID 61000963
1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)-N-ethylethanamine
CID 106692130
2-(2-bromo-3-fluorophenyl)-1-(5-chlorofuran-2-yl)-N-ethylethanamine
CID 106692784
1-(2,5-dimethylphenyl)-N-ethyl-2-thiophen-2-ylethanamine
CID 61064099

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine?
The IUPAC name of 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine (CID 106687804) is 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine.
What is the SMILES notation for 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine?
The canonical SMILES for 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine is CCNC(Cc1cccs1)c1ccc(Cl)o1.
What is the InChIKey of 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine?
The InChIKey is IECJYLUOGQQBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClNOS/c1-2-14-10(8-9-4-3-7-16-9)11-5-6-12(13)15-11/h3-7,10,14H,2,8H2,1H3.
What are the key properties of 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine?
1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine has a molecular weight of 255.77 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine is sourced from PubChem (CID 106687804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).