5-ethyl-1,3-thiazol-2-amine;thiourea

C6H12N4S2 — CID 160637365

IUPAC5-ethyl-1,3-thiazol-2-amine;thiourea
SMILESCCc1cnc(N)s1.NC(N)=S
InChIInChI=1S/C5H8N2S.CH4N2S/c1-2-4-3-7-5(6)8-4;2-1(3)4/h3H,2H2,1H3,(H2,6,7);(H4,2,3,4)
InChIKeyRISDUHCAWYYQIC-UHFFFAOYSA-N
MW204.32 g/mol
LogP0.48
Rot. Bonds1

About 5-ethyl-1,3-thiazol-2-amine;thiourea

5-ethyl-1,3-thiazol-2-amine;thiourea (PubChem CID 160637365) has the molecular formula C6H12N4S2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 5-ethyl-1,3-thiazol-2-amine;thiourea.

Molecular Properties

Compound Name5-ethyl-1,3-thiazol-2-amine;thiourea
PubChem CID160637365
Molecular FormulaC6H12N4S2
Molecular Weight204.32 g/mol
Exact Mass204.05
IUPAC Name5-ethyl-1,3-thiazol-2-amine;thiourea
SMILESCCc1cnc(N)s1.NC(N)=S
InChIInChI=1S/C5H8N2S.CH4N2S/c1-2-4-3-7-5(6)8-4;2-1(3)4/h3H,2H2,1H3,(H2,6,7);(H4,2,3,4)
InChIKeyRISDUHCAWYYQIC-UHFFFAOYSA-N
XLogP0.48
TPSA90.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-Amino-5-methylthiazole
CID 351770
5-(2-Aminoethyl)-1,3-thiazol-2-amine
CID 13637167
5-Ethyl-1,3-thiazol-2-amine
CID 12737257
5-tert-Butyl-1,3-thiazol-2-amine
CID 676485
5-Propyl-1,3-thiazol-2-amine
CID 3282236
5-(Propan-2-yl)-1,3-thiazol-2-amine
CID 10486954
5-[2-(Dimethylamino)ethyl]-1,3-thiazol-2-amine
CID 12284087
2-[(2-Guanidinothiazol-5-yl)methylthio]ethylamine
CID 13102899
5-[2-(Methylamino)ethyl]-1,3-thiazol-2-amine
CID 13637169
5-Cyclobutyl-1,3-thiazol-2-amine
CID 12991423
5-(2-Aminoethyl)-1,3-thiazol-2-amine--hydrogen chloride (1/2)
CID 13637168
5-Cyclopropyl-1,3-thiazol-2-amine
CID 22170679

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1,3-thiazol-2-amine;thiourea?
The IUPAC name of 5-ethyl-1,3-thiazol-2-amine;thiourea (CID 160637365) is 5-ethyl-1,3-thiazol-2-amine;thiourea.
What is the SMILES notation for 5-ethyl-1,3-thiazol-2-amine;thiourea?
The canonical SMILES for 5-ethyl-1,3-thiazol-2-amine;thiourea is CCc1cnc(N)s1.NC(N)=S.
What is the InChIKey of 5-ethyl-1,3-thiazol-2-amine;thiourea?
The InChIKey is RISDUHCAWYYQIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2S.CH4N2S/c1-2-4-3-7-5(6)8-4;2-1(3)4/h3H,2H2,1H3,(H2,6,7);(H4,2,3,4).
What are the key properties of 5-ethyl-1,3-thiazol-2-amine;thiourea?
5-ethyl-1,3-thiazol-2-amine;thiourea has a molecular weight of 204.32 g/mol, XLogP of 0.48, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1,3-thiazol-2-amine;thiourea is sourced from PubChem (CID 160637365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).