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

C10H11N3S — CID 112642722

IUPAC1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine
SMILESNC(Cc1cncs1)c1ccncc1
InChIInChI=1S/C10H11N3S/c11-10(5-9-6-13-7-14-9)8-1-3-12-4-2-8/h1-4,6-7,10H,5,11H2
InChIKeyKGAURSQKFNVVRL-UHFFFAOYSA-N
MW205.29 g/mol
LogP1.78
Rot. Bonds3

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

1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine (PubChem CID 112642722) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine
PubChem CID112642722
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine
SMILESNC(Cc1cncs1)c1ccncc1
InChIInChI=1S/C10H11N3S/c11-10(5-9-6-13-7-14-9)8-1-3-12-4-2-8/h1-4,6-7,10H,5,11H2
InChIKeyKGAURSQKFNVVRL-UHFFFAOYSA-N
XLogP1.78
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanol
CID 112641839
1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112642945
1-(5-iodothiophen-3-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105030806
2-(1,3-thiazol-5-yl)-1-[4-(trifluoromethoxy)phenyl]ethanamine
CID 105030569
1-(3-bromo-4-fluorophenyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 112643573
1-(3,5-dimethoxyphenyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105030712
1-(5-bromofuran-3-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 131031441
1-(2,3,4,5,6-pentafluorophenyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105030337
1-(1,3-thiazol-5-yl)propan-2-amine
CID 60748054
1-(3-methyl-2-pyridinyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 112642901
1-pyridin-4-yl-N-(1,3-thiazol-5-ylmethyl)ethanamine
CID 62758658
2-(1,3-thiazol-5-yl)-1-(2H-triazol-4-yl)ethanamine
CID 112643460

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine?
The IUPAC name of 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine (CID 112642722) is 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine.
What is the SMILES notation for 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine?
The canonical SMILES for 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine is NC(Cc1cncs1)c1ccncc1.
What is the InChIKey of 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine?
The InChIKey is KGAURSQKFNVVRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c11-10(5-9-6-13-7-14-9)8-1-3-12-4-2-8/h1-4,6-7,10H,5,11H2.
What are the key properties of 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine?
1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine has a molecular weight of 205.29 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine is sourced from PubChem (CID 112642722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).