2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine

C15H14N4S — CID 82069621

IUPAC2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine
SMILESNCCc1sc(-c2ccncc2)nc1-c1cccnc1
InChIInChI=1S/C15H14N4S/c16-6-3-13-14(12-2-1-7-18-10-12)19-15(20-13)11-4-8-17-9-5-11/h1-2,4-5,7-10H,3,6,16H2
InChIKeyPNJDNEIJAYAHBD-UHFFFAOYSA-N
MW282.37 g/mol
LogP2.77
Rot. Bonds4

About 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine

2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine (PubChem CID 82069621) has the molecular formula C15H14N4S and a molecular weight of 282.37 g/mol. Its IUPAC name is 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine
PubChem CID82069621
Molecular FormulaC15H14N4S
Molecular Weight282.37 g/mol
Exact Mass282.09
IUPAC Name2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine
SMILESNCCc1sc(-c2ccncc2)nc1-c1cccnc1
InChIInChI=1S/C15H14N4S/c16-6-3-13-14(12-2-1-7-18-10-12)19-15(20-13)11-4-8-17-9-5-11/h1-2,4-5,7-10H,3,6,16H2
InChIKeyPNJDNEIJAYAHBD-UHFFFAOYSA-N
XLogP2.77
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(3-methylphenyl)-4-pyridin-3-yl-1,3-thiazol-5-yl]ethanamine
CID 82069588
2-[2-(3-methoxyphenyl)-4-pyridin-3-yl-1,3-thiazol-5-yl]ethanamine
CID 93216550
2-[4-(4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazol-5-yl]ethanamine
CID 93216544
2-(2,4-dipyridin-3-yl-1,3-thiazol-5-yl)acetic acid
CID 82069424
2-(4-phenyl-2-thiophen-3-yl-1,3-thiazol-5-yl)ethanamine
CID 79786144
2-[4-phenyl-2-(pyridin-4-ylmethyl)-1,3-thiazol-5-yl]ethanamine
CID 79782596
2-(2-propan-2-yl-4-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine
CID 82069487
N-[(4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-yl)methyl]aniline
CID 53494006
5-(chloromethyl)-2-pyridin-3-yl-4-thiophen-2-yl-1,3-thiazole
CID 28709866
2-[4-(2-methoxyphenyl)-2-phenyl-1,3-thiazol-5-yl]ethanamine
CID 93216518
2-(4-pyridin-3-yl-1,3-thiazol-2-yl)ethanamine
CID 24690096
O-[2-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]hydroxylamine
CID 143129382

Frequently Asked Questions

What is the IUPAC name of 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine?
The IUPAC name of 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine (CID 82069621) is 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine.
What is the SMILES notation for 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine?
The canonical SMILES for 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine is NCCc1sc(-c2ccncc2)nc1-c1cccnc1.
What is the InChIKey of 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine?
The InChIKey is PNJDNEIJAYAHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4S/c16-6-3-13-14(12-2-1-7-18-10-12)19-15(20-13)11-4-8-17-9-5-11/h1-2,4-5,7-10H,3,6,16H2.
What are the key properties of 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine?
2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine has a molecular weight of 282.37 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyridin-3-yl-2-pyridin-4-yl-1,3-thiazol-5-yl)ethanamine is sourced from PubChem (CID 82069621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).