4-methyl-4,5-dihydro-1,3-thiazol-2-amine

C4H8N2S — CID 568239

IUPAC4-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CSC(N)=N1
InChIInChI=1S/C4H8N2S/c1-3-2-7-4(5)6-3/h3H,2H2,1H3,(H2,5,6)
InChIKeySILRNKZBMNSABG-UHFFFAOYSA-N
MW116.19 g/mol
LogP0.44
Rot. Bonds

About 4-methyl-4,5-dihydro-1,3-thiazol-2-amine

4-methyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 568239) has the molecular formula C4H8N2S and a molecular weight of 116.19 g/mol. Its IUPAC name is 4-methyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID568239
Molecular FormulaC4H8N2S
Molecular Weight116.19 g/mol
Exact Mass116.04
IUPAC Name4-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CSC(N)=N1
InChIInChI=1S/C4H8N2S/c1-3-2-7-4(5)6-3/h3H,2H2,1H3,(H2,5,6)
InChIKeySILRNKZBMNSABG-UHFFFAOYSA-N
XLogP0.44
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.19
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-5,6-dihydro-6-methyl-4H-1,3-thiazine
CID 1534
Tocris-0871
CID 6603722
2-Amino-5,6-dihydro-4H-1,3-thiazine
CID 189081
4-Butyl-thiazolidin-(2E)-ylideneamine
CID 9812839
(4r,5r)-5-Ethyl-2-imino-4-methyl-1,3-thiazolidine
CID 9795163
5-Methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 544920
2-(3-Methylsulfanylpropyl)guanidine
CID 44158315
2-Amino-4-ethyl-2-thiazoline
CID 15468264
2-Amino-5-methyl-2-thiazoline hydrobromide
CID 129831691
2-(2-Aminopropyl)-1-methyl-2-thiopseudourea
CID 6451601
(4S,5R,6R)-5-fluoro-4,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 118441148
(4S,5S)-5-fluoro-4-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 118441149

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-4,5-dihydro-1,3-thiazol-2-amine (CID 568239) is 4-methyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-4,5-dihydro-1,3-thiazol-2-amine is CC1CSC(N)=N1.
What is the InChIKey of 4-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is SILRNKZBMNSABG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2S/c1-3-2-7-4(5)6-3/h3H,2H2,1H3,(H2,5,6).
What are the key properties of 4-methyl-4,5-dihydro-1,3-thiazol-2-amine?
4-methyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 116.19 g/mol, XLogP of 0.44, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 568239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).