4-prop-2-enyl-1,3-thiazol-2-amine

C6H8N2S — CID 23062256

IUPAC4-prop-2-enyl-1,3-thiazol-2-amine
SMILESC=CCc1csc(N)n1
InChIInChI=1S/C6H8N2S/c1-2-3-5-4-9-6(7)8-5/h2,4H,1,3H2,(H2,7,8)
InChIKeyHPWXPPDPHLNDLJ-UHFFFAOYSA-N
MW140.21 g/mol
LogP1.45
Rot. Bonds2

About 4-prop-2-enyl-1,3-thiazol-2-amine

4-prop-2-enyl-1,3-thiazol-2-amine (PubChem CID 23062256) has the molecular formula C6H8N2S and a molecular weight of 140.21 g/mol. Its IUPAC name is 4-prop-2-enyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-prop-2-enyl-1,3-thiazol-2-amine
PubChem CID23062256
Molecular FormulaC6H8N2S
Molecular Weight140.21 g/mol
Exact Mass140.04
IUPAC Name4-prop-2-enyl-1,3-thiazol-2-amine
SMILESC=CCc1csc(N)n1
InChIInChI=1S/C6H8N2S/c1-2-3-5-4-9-6(7)8-5/h2,4H,1,3H2,(H2,7,8)
InChIKeyHPWXPPDPHLNDLJ-UHFFFAOYSA-N
XLogP1.45
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.21
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-prop-2-enyl-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Amino-4-methylthiazole
CID 74143
2-Thiazolamine, 4-methyl-, hydrochloride (1:1)
CID 80240
4-tert-Butyl-1,3-thiazol-2-amine
CID 2734202
4-Cyclopropyl-1,3-thiazol-2-amine
CID 674456
4-Ethyl-1,3-thiazol-2-amine
CID 12378205
N-(4-methyl-1,3-thiazol-2-yl)guanidine
CID 2776666
Agr 307
CID 73233
4-(2-Aminoethyl)-1,3-thiazol-2-amine
CID 10964631
4-Cyclobutyl-1,3-thiazol-2-amine
CID 22063634
4-(Propan-2-yl)-1,3-thiazol-2-amine
CID 7064077
N''-(4-Methyl-1,3-thiazol-2-yl)guanidine--hydrogen chloride (1/1)
CID 2776665
4-(Trideuteriomethyl)-1,3-thiazol-2-amine
CID 45785356

Frequently Asked Questions

What is the IUPAC name of 4-prop-2-enyl-1,3-thiazol-2-amine?
The IUPAC name of 4-prop-2-enyl-1,3-thiazol-2-amine (CID 23062256) is 4-prop-2-enyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-prop-2-enyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-prop-2-enyl-1,3-thiazol-2-amine is C=CCc1csc(N)n1.
What is the InChIKey of 4-prop-2-enyl-1,3-thiazol-2-amine?
The InChIKey is HPWXPPDPHLNDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2S/c1-2-3-5-4-9-6(7)8-5/h2,4H,1,3H2,(H2,7,8).
What are the key properties of 4-prop-2-enyl-1,3-thiazol-2-amine?
4-prop-2-enyl-1,3-thiazol-2-amine has a molecular weight of 140.21 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-prop-2-enyl-1,3-thiazol-2-amine is sourced from PubChem (CID 23062256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).