1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine

C10H10ClN3S — CID 103445012

IUPAC1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine
SMILESCC(N)c1csc(-c2ncccc2Cl)n1
InChIInChI=1S/C10H10ClN3S/c1-6(12)8-5-15-10(14-8)9-7(11)3-2-4-13-9/h2-6H,12H2,1H3
InChIKeyOGABDRSHQOFUKA-UHFFFAOYSA-N
MW239.73 g/mol
LogP2.88
Rot. Bonds2

About 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine

1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine (PubChem CID 103445012) has the molecular formula C10H10ClN3S and a molecular weight of 239.73 g/mol. Its IUPAC name is 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine.

Molecular Properties

Compound Name1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine
PubChem CID103445012
Molecular FormulaC10H10ClN3S
Molecular Weight239.73 g/mol
Exact Mass239.03
IUPAC Name1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine
SMILESCC(N)c1csc(-c2ncccc2Cl)n1
InChIInChI=1S/C10H10ClN3S/c1-6(12)8-5-15-10(14-8)9-7(11)3-2-4-13-9/h2-6H,12H2,1H3
InChIKeyOGABDRSHQOFUKA-UHFFFAOYSA-N
XLogP2.88
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.73
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-chloro-2-pyridinyl)-4-(methoxymethyl)-1,3-thiazole
CID 107511905
1-(2-phenyl-1,3-thiazol-4-yl)ethanamine
CID 12009827
(1R)-1-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]ethanamine
CID 95377650
1-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]ethanamine
CID 64544065
1-[2-(3-bromo-4-chlorophenyl)-1,3-thiazol-4-yl]ethanamine
CID 115568091
(1S)-1-(3-chloro-2-pyridinyl)ethanamine
CID 103663393
methyl 2-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]acetate
CID 103442928
1-[2-(3-ethyl-2-pyridinyl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 82741332
1-[2-(1-benzothiophen-3-yl)-1,3-thiazol-4-yl]ethanamine
CID 64542695
3-chloro-2-(3-chloro-2-pyridinyl)pyridine;palladium(2+)
CID 18935247
N-[4-(1-aminoethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
CID 64557648
1-(2-isoquinolin-4-yl-1,3-thiazol-4-yl)ethanamine
CID 104504761

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine?
The IUPAC name of 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine (CID 103445012) is 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine.
What is the SMILES notation for 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine?
The canonical SMILES for 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine is CC(N)c1csc(-c2ncccc2Cl)n1.
What is the InChIKey of 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine?
The InChIKey is OGABDRSHQOFUKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3S/c1-6(12)8-5-15-10(14-8)9-7(11)3-2-4-13-9/h2-6H,12H2,1H3.
What are the key properties of 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine?
1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine has a molecular weight of 239.73 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine is sourced from PubChem (CID 103445012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).