1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine

C9H9ClN2S2 — CID 105014977

IUPAC1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
SMILESNC(Cc1nccs1)c1ccc(Cl)s1
InChIInChI=1S/C9H9ClN2S2/c10-8-2-1-7(14-8)6(11)5-9-12-3-4-13-9/h1-4,6H,5,11H2
InChIKeyJRNNPWKNWUNOQC-UHFFFAOYSA-N
MW244.77 g/mol
LogP3.10
Rot. Bonds3

About 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine

1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine (PubChem CID 105014977) has the molecular formula C9H9ClN2S2 and a molecular weight of 244.77 g/mol. Its IUPAC name is 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
PubChem CID105014977
Molecular FormulaC9H9ClN2S2
Molecular Weight244.77 g/mol
Exact Mass243.99
IUPAC Name1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
SMILESNC(Cc1nccs1)c1ccc(Cl)s1
InChIInChI=1S/C9H9ClN2S2/c10-8-2-1-7(14-8)6(11)5-9-12-3-4-13-9/h1-4,6H,5,11H2
InChIKeyJRNNPWKNWUNOQC-UHFFFAOYSA-N
XLogP3.10
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.77
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105015351
1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
CID 130594678
1-(5-chlorothiophen-2-yl)-2-(4-iodophenyl)ethanamine
CID 115864081
(1R)-1-(5-chlorothiophen-2-yl)propan-1-amine;hydrochloride
CID 171200569
(1S)-1-(5-chlorothiophen-2-yl)propane-1,3-diamine;hydrochloride
CID 171220102
1-(5-chlorothiophen-2-yl)-3,3,3-trifluoropropan-1-amine
CID 43114604
1-(5-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol
CID 79824094
1-(5-chlorothiophen-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 115821386
1-(5-chlorothiophen-2-yl)-2-quinolin-2-ylethanamine
CID 62277076
(1R)-1-(5-chlorothiophen-2-yl)-3-methylbutan-1-amine;hydrochloride
CID 171200575
(1R)-1-(5-chlorothiophen-2-yl)-3,3,3-trifluoropropan-1-amine;hydrochloride
CID 171200577
1-(5-chlorothiophen-2-yl)-2-piperidin-1-ylethanamine
CID 82294536

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine (CID 105014977) is 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine is NC(Cc1nccs1)c1ccc(Cl)s1.
What is the InChIKey of 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine?
The InChIKey is JRNNPWKNWUNOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN2S2/c10-8-2-1-7(14-8)6(11)5-9-12-3-4-13-9/h1-4,6H,5,11H2.
What are the key properties of 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine?
1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine has a molecular weight of 244.77 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 105014977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).