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

C9H11N3S2 — CID 105177899

IUPAC1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine
SMILESCc1ncsc1C(N)Cc1cncs1
InChIInChI=1S/C9H11N3S2/c1-6-9(14-5-12-6)8(10)2-7-3-11-4-13-7/h3-5,8H,2,10H2,1H3
InChIKeyHOYTYPBHTQFHRR-UHFFFAOYSA-N
MW225.34 g/mol
LogP2.15
Rot. Bonds3

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

1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine (PubChem CID 105177899) has the molecular formula C9H11N3S2 and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine
PubChem CID105177899
Molecular FormulaC9H11N3S2
Molecular Weight225.34 g/mol
Exact Mass225.04
IUPAC Name1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine
SMILESCc1ncsc1C(N)Cc1cncs1
InChIInChI=1S/C9H11N3S2/c1-6-9(14-5-12-6)8(10)2-7-3-11-4-13-7/h3-5,8H,2,10H2,1H3
InChIKeyHOYTYPBHTQFHRR-UHFFFAOYSA-N
XLogP2.15
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5-chlorothiophen-2-yl)-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 105135057
1-(4-methyl-1,3-thiazol-5-yl)propan-1-amine
CID 82416051
2-methoxy-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 82411798
1-(4-methyl-1,3-thiazol-5-yl)-2-phenylethanamine
CID 105084585
1-(1,3-thiazol-5-yl)propan-2-amine
CID 60748054
1-(4-methylthiophen-2-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 131042710
1-(3-methyl-2-pyridinyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 112642901
1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine
CID 112642722
1-(2,3,4,5,6-pentafluorophenyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105030337
2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 105138914
1-(3,5-dimethoxyphenyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105030712
1-(5-iodothiophen-3-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105030806

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine?
The IUPAC name of 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine (CID 105177899) is 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine.
What is the SMILES notation for 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine?
The canonical SMILES for 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine is Cc1ncsc1C(N)Cc1cncs1.
What is the InChIKey of 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine?
The InChIKey is HOYTYPBHTQFHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3S2/c1-6-9(14-5-12-6)8(10)2-7-3-11-4-13-7/h3-5,8H,2,10H2,1H3.
What are the key properties of 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine?
1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine has a molecular weight of 225.34 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-1,3-thiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine is sourced from PubChem (CID 105177899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).