1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine

C9H12N4S — CID 106571781

IUPAC1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
SMILESCc1csc(CCn2ccnc2N)n1
InChIInChI=1S/C9H12N4S/c1-7-6-14-8(12-7)2-4-13-5-3-11-9(13)10/h3,5-6H,2,4H2,1H3,(H2,10,11)
InChIKeyWQMYMVRDDPVWCN-UHFFFAOYSA-N
MW208.29 g/mol
LogP1.47
Rot. Bonds3

About 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine

1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine (PubChem CID 106571781) has the molecular formula C9H12N4S and a molecular weight of 208.29 g/mol. Its IUPAC name is 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound Name1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
PubChem CID106571781
Molecular FormulaC9H12N4S
Molecular Weight208.29 g/mol
Exact Mass208.08
IUPAC Name1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
SMILESCc1csc(CCn2ccnc2N)n1
InChIInChI=1S/C9H12N4S/c1-7-6-14-8(12-7)2-4-13-5-3-11-9(13)10/h3,5-6H,2,4H2,1H3,(H2,10,11)
InChIKeyWQMYMVRDDPVWCN-UHFFFAOYSA-N
XLogP1.47
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,4-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571785
4-[2-[2-(2-methylimidazol-1-yl)ethyl]-1,3-thiazol-4-yl]aniline
CID 84818101
ethyl 5-amino-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazole-4-carboxylate
CID 63240207
2-(4-methyl-1,3-thiazol-2-yl)-1-(1-propylimidazol-2-yl)ethanone
CID 63975439
1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazo[4,5-c]pyridin-2-amine
CID 79296254
(1R)-1-[3-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-4-yl]propan-1-amine
CID 104943036
2-ethyl-4-methyl-1,3-thiazole
CID 27440
1-butylimidazol-2-amine
CID 60860613
1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperazine-2,5-dione
CID 64955773
3-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 1497792
2-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]isoindole-1,3-dione
CID 1497777
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]-1-propan-2-ylimidazol-2-amine
CID 106571805

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine?
The IUPAC name of 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine (CID 106571781) is 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine?
The canonical SMILES for 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine is Cc1csc(CCn2ccnc2N)n1.
What is the InChIKey of 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine?
The InChIKey is WQMYMVRDDPVWCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4S/c1-7-6-14-8(12-7)2-4-13-5-3-11-9(13)10/h3,5-6H,2,4H2,1H3,(H2,10,11).
What are the key properties of 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine?
1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine has a molecular weight of 208.29 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106571781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).