N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine

C6H10N2S — CID 588291

IUPACN-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESC=CCNC1=NCCS1
InChIInChI=1S/C6H10N2S/c1-2-3-7-6-8-4-5-9-6/h2H,1,3-5H2,(H,7,8)
InChIKeyRDBNJKNWWYRKGA-UHFFFAOYSA-N
MW142.23 g/mol
LogP0.86
Rot. Bonds2

About N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine

N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 588291) has the molecular formula C6H10N2S and a molecular weight of 142.23 g/mol. Its IUPAC name is N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID588291
Molecular FormulaC6H10N2S
Molecular Weight142.23 g/mol
Exact Mass142.06
IUPAC NameN-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESC=CCNC1=NCCS1
InChIInChI=1S/C6H10N2S/c1-2-3-7-6-8-4-5-9-6/h2H,1,3-5H2,(H,7,8)
InChIKeyRDBNJKNWWYRKGA-UHFFFAOYSA-N
XLogP0.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.23
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-methylidene-N-prop-2-enyl-4H-1,3-thiazol-2-amine
CID 70560695
2-Allylthio-4,5-dihydroimidazole
CID 437652
2-(2-fluoroprop-2-enylsulfanyl)-4,5-dihydro-1H-imidazole
CID 413822
3-[N,N'-bis(prop-2-enyl)carbamimidoyl]sulfanylpropyl N,N'-bis(prop-2-enyl)carbamimidothioate
CID 20442839
2-[N,N'-bis(prop-2-enyl)carbamimidoyl]sulfanylethyl N,N'-bis(prop-2-enyl)carbamimidothioate
CID 54466621
2-prop-2-enylsulfanyl-4,5-dihydro-1H-imidazole;hydroiodide
CID 70394470
methyl N,N'-bis(prop-2-enyl)carbamimidothioate
CID 88476825
prop-2-enyl N-cyano-N'-prop-2-enylcarbamimidothioate
CID 88740284
[Ethylsulfanyl-(prop-2-enylamino)methylidene]-prop-2-enylazanium iodide
CID 88812386
prop-1-enyl N-ethyl-N'-methylcarbamimidothioate
CID 124018626
methyl N'-methyl-N-prop-2-enylcarbamimidothioate
CID 144497619
ethyl N,N'-bis(prop-2-enyl)carbamimidothioate;hydroiodide
CID 173452158

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine (CID 588291) is N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine is C=CCNC1=NCCS1.
What is the InChIKey of N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is RDBNJKNWWYRKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S/c1-2-3-7-6-8-4-5-9-6/h2H,1,3-5H2,(H,7,8).
What are the key properties of N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine?
N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 142.23 g/mol, XLogP of 0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 588291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).