1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea

C6H10N4OS — CID 86807489

IUPAC1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea
SMILESCCN(C)C(=O)Nc1cnns1
InChIInChI=1S/C6H10N4OS/c1-3-10(2)6(11)8-5-4-7-9-12-5/h4H,3H2,1-2H3,(H,8,11)
InChIKeyQLQDSUQMKOCUQL-UHFFFAOYSA-N
MW186.24 g/mol
LogP1.02
Rot. Bonds2

About 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea

1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea (PubChem CID 86807489) has the molecular formula C6H10N4OS and a molecular weight of 186.24 g/mol. Its IUPAC name is 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea.

Molecular Properties

Compound Name1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea
PubChem CID86807489
Molecular FormulaC6H10N4OS
Molecular Weight186.24 g/mol
Exact Mass186.06
IUPAC Name1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea
SMILESCCN(C)C(=O)Nc1cnns1
InChIInChI=1S/C6H10N4OS/c1-3-10(2)6(11)8-5-4-7-9-12-5/h4H,3H2,1-2H3,(H,8,11)
InChIKeyQLQDSUQMKOCUQL-UHFFFAOYSA-N
XLogP1.02
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.24
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-Methoxyethyl)-3-(thiadiazol-5-yl)urea
CID 118947625
N-1,2,3-Thiadiazol-5-ylurea
CID 18352222
1-Butyl-1-ethyl-3-(thiadiazol-5-yl)urea
CID 99836113
N-Cyclopentyl-N'-1,2,3-thiadiazol-5-ylurea
CID 23044826
1-(Thiadiazol-5-yl)-3-(2,2,2-trifluoroethyl)urea
CID 107649831
3,3-difluoro-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide
CID 128069727
3-fluoro-3-methyl-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide
CID 128069969
1-(2-Fluoroethyl)-3-(thiadiazol-5-yl)urea
CID 130668369
1-(1-Fluoropropan-2-yl)-3-(thiadiazol-5-yl)urea
CID 130679934
1-(2,2-Difluoroethyl)-1-methyl-3-(thiadiazol-5-yl)urea
CID 132297949
N-(thiadiazol-5-yl)-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboxamide
CID 137925604
1,3-Dimethyl-1-(thiadiazol-5-yl)thiourea
CID 12272246

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea?
The IUPAC name of 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea (CID 86807489) is 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea.
What is the SMILES notation for 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea?
The canonical SMILES for 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea is CCN(C)C(=O)Nc1cnns1.
What is the InChIKey of 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea?
The InChIKey is QLQDSUQMKOCUQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4OS/c1-3-10(2)6(11)8-5-4-7-9-12-5/h4H,3H2,1-2H3,(H,8,11).
What are the key properties of 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea?
1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea has a molecular weight of 186.24 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-methyl-3-(thiadiazol-5-yl)urea is sourced from PubChem (CID 86807489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).