1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea

C15H15N3O2S — CID 30375764

IUPAC1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea
SMILESCCN1C(=O)Cc2cc(NC(=O)Nc3cccs3)ccc21
InChIInChI=1S/C15H15N3O2S/c1-2-18-12-6-5-11(8-10(12)9-14(18)19)16-15(20)17-13-4-3-7-21-13/h3-8H,2,9H2,1H3,(H2,16,17,20)
InChIKeyLCSGQTZSNLKDOG-UHFFFAOYSA-N
MW301.37 g/mol
LogP3.30
Rot. Bonds3

About 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea

1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea (PubChem CID 30375764) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea.

Molecular Properties

Compound Name1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea
PubChem CID30375764
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC Name1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea
SMILESCCN1C(=O)Cc2cc(NC(=O)Nc3cccs3)ccc21
InChIInChI=1S/C15H15N3O2S/c1-2-18-12-6-5-11(8-10(12)9-14(18)19)16-15(20)17-13-4-3-7-21-13/h3-8H,2,9H2,1H3,(H2,16,17,20)
InChIKeyLCSGQTZSNLKDOG-UHFFFAOYSA-N
XLogP3.30
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethyl-2-oxo-3H-indol-5-yl)acetamide
CID 20933157
1-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-thiophen-2-ylurea
CID 30376060
1-(4-butoxyphenyl)-3-(1-ethyl-2-oxo-3H-indol-5-yl)urea
CID 30375820
N-(1-ethyl-2-oxo-3H-indol-5-yl)thiophene-2-sulfonamide
CID 41342430
2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide
CID 27639248
1-[(4-chlorophenyl)methyl]-3-(1-ethyl-2-oxo-3H-indol-5-yl)urea
CID 30375770
1-ethyl-5-(methylamino)-3H-indol-2-one
CID 82551072
1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-(naphthalen-1-ylmethyl)urea
CID 30375844
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-thiophen-2-ylacetamide
CID 40946944
1-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-(3-methylphenyl)urea
CID 30376245
3-[(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)carbamoylamino]propanoic acid
CID 122089851
N-(1-ethyl-2-oxo-3H-indol-5-yl)-3-(4-methylsulfonylphenyl)propanamide
CID 91624454

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea?
The IUPAC name of 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea (CID 30375764) is 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea.
What is the SMILES notation for 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea?
The canonical SMILES for 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea is CCN1C(=O)Cc2cc(NC(=O)Nc3cccs3)ccc21.
What is the InChIKey of 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea?
The InChIKey is LCSGQTZSNLKDOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-2-18-12-6-5-11(8-10(12)9-14(18)19)16-15(20)17-13-4-3-7-21-13/h3-8H,2,9H2,1H3,(H2,16,17,20).
What are the key properties of 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea?
1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea has a molecular weight of 301.37 g/mol, XLogP of 3.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea is sourced from PubChem (CID 30375764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).