ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine

C8H14N2S — CID 177047215

IUPACethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine
SMILESC=Cc1sc(N)nc1C.CC
InChIInChI=1S/C6H8N2S.C2H6/c1-3-5-4(2)8-6(7)9-5;1-2/h3H,1H2,2H3,(H2,7,8);1-2H3
InChIKeyNNXGSQIHULEJGD-UHFFFAOYSA-N
MW170.28 g/mol
LogP2.70
Rot. Bonds1

About ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine

ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine (PubChem CID 177047215) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Nameethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine
PubChem CID177047215
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC Nameethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine
SMILESC=Cc1sc(N)nc1C.CC
InChIInChI=1S/C6H8N2S.C2H6/c1-3-5-4(2)8-6(7)9-5;1-2/h3H,1H2,2H3,(H2,7,8);1-2H3
InChIKeyNNXGSQIHULEJGD-UHFFFAOYSA-N
XLogP2.70
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1-bromoethenyl)-5-ethenyl-1,3-thiazol-2-amine
CID 145443882
5-ethenyl-4-[(3Z)-5-methyl-5-propylocta-1,3-dien-4-yl]-1,3-thiazol-2-amine
CID 170140043
4,5-dimethyl-1,3-thiazol-2-amine bromide
CID 21234862
4-methyl-5-methylsulfonyl-1,3-thiazol-2-amine
CID 91306499
5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride
CID 71757840
5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine
CID 24820452
2,4-dimethyl-1,3-thiazole-5-carbaldehyde;ethane
CID 142103323
5-[(1Z)-buta-1,3-dienyl]-2,4-dimethyl-1,3-thiazole;ethane
CID 143165209
2-amino-5-methyl-1,3-thiazole-4-carbaldehyde
CID 45083446
5-(1-aminoethyl)-4-methyl-1,3-thiazol-2-amine
CID 61295642
disodium;2-(5-ethenyl-4-methyl-1,3-thiazol-2-yl)ethane-1,1-disulfonate
CID 155663630
5-(1-fluoroethyl)-4-methyl-1,3-thiazol-2-amine
CID 83853616

Frequently Asked Questions

What is the IUPAC name of ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine (CID 177047215) is ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine is C=Cc1sc(N)nc1C.CC.
What is the InChIKey of ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine?
The InChIKey is NNXGSQIHULEJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2S.C2H6/c1-3-5-4(2)8-6(7)9-5;1-2/h3H,1H2,2H3,(H2,7,8);1-2H3.
What are the key properties of ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine?
ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine has a molecular weight of 170.28 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-ethenyl-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 177047215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).