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

C10H12N2S2 — CID 66351418

IUPACN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine
SMILESCc1nc(C(C)Nc2ccsc2)cs1
InChIInChI=1S/C10H12N2S2/c1-7(10-6-14-8(2)12-10)11-9-3-4-13-5-9/h3-7,11H,1-2H3
InChIKeyXNLGJYYGFXNPRG-UHFFFAOYSA-N
MW224.35 g/mol
LogP3.69
Rot. Bonds3

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

N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine (PubChem CID 66351418) has the molecular formula C10H12N2S2 and a molecular weight of 224.35 g/mol. Its IUPAC name is N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine.

Molecular Properties

Compound NameN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine
PubChem CID66351418
Molecular FormulaC10H12N2S2
Molecular Weight224.35 g/mol
Exact Mass224.04
IUPAC NameN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine
SMILESCc1nc(C(C)Nc2ccsc2)cs1
InChIInChI=1S/C10H12N2S2/c1-7(10-6-14-8(2)12-10)11-9-3-4-13-5-9/h3-7,11H,1-2H3
InChIKeyXNLGJYYGFXNPRG-UHFFFAOYSA-N
XLogP3.69
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidin-5-amine
CID 107588200
4-N,4-N-dimethyl-1-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzene-1,4-diamine
CID 43670343
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-phenylaniline
CID 43716894
3,4-dichloro-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]aniline
CID 43670072
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine
CID 43680346
3-fluoro-4-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]aniline
CID 43670116
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-propylaniline
CID 43670202
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,3-dihydro-1H-inden-5-amine
CID 43670073
2-methylsulfanyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]aniline
CID 43683530
N-[1-(1-methyltriazol-4-yl)ethyl]thiophen-3-amine
CID 165353746
2-tert-butyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]aniline
CID 43682979
5-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]isoindole-1,3-dione
CID 43670137

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine?
The IUPAC name of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine (CID 66351418) is N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine.
What is the SMILES notation for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine?
The canonical SMILES for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine is Cc1nc(C(C)Nc2ccsc2)cs1.
What is the InChIKey of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine?
The InChIKey is XNLGJYYGFXNPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2S2/c1-7(10-6-14-8(2)12-10)11-9-3-4-13-5-9/h3-7,11H,1-2H3.
What are the key properties of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine?
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine has a molecular weight of 224.35 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine is sourced from PubChem (CID 66351418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).