1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea

C19H21N3O — CID 40519720

IUPAC1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea
SMILESCCn1cc(NC(=O)Nc2cccc(C)c2C)c2ccccc21
InChIInChI=1S/C19H21N3O/c1-4-22-12-17(15-9-5-6-11-18(15)22)21-19(23)20-16-10-7-8-13(2)14(16)3/h5-12H,4H2,1-3H3,(H2,20,21,23)
InChIKeyMFENDSAVAPAVTA-UHFFFAOYSA-N
MW307.40 g/mol
LogP4.92
Rot. Bonds3

About 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea

1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea (PubChem CID 40519720) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea.

Molecular Properties

Compound Name1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea
PubChem CID40519720
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea
SMILESCCn1cc(NC(=O)Nc2cccc(C)c2C)c2ccccc21
InChIInChI=1S/C19H21N3O/c1-4-22-12-17(15-9-5-6-11-18(15)22)21-19(23)20-16-10-7-8-13(2)14(16)3/h5-12H,4H2,1-3H3,(H2,20,21,23)
InChIKeyMFENDSAVAPAVTA-UHFFFAOYSA-N
XLogP4.92
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea 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

1,1-diethyl-3-(1-ethylindol-3-yl)urea
CID 40519589
1-(4-ethoxyphenyl)-3-(1-ethylindol-3-yl)urea
CID 18582412
3-(1-ethylindol-3-yl)-1,1-bis(2-methylpropyl)urea
CID 40519593
1-benzyl-N-(2,3-dimethylphenyl)indole-3-carboxamide
CID 24661406
1-(1-ethylindol-3-yl)-3-[2-(4-fluorophenyl)ethyl]urea
CID 18582399
N-(2,3-dimethylphenyl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxamide
CID 39850888
2-(3-benzoylindol-1-yl)-N-(2,3-dimethylphenyl)acetamide
CID 2953381
1-ethyl-N-(2-methyl-3-nitrophenyl)-4-oxoquinoline-3-carboxamide
CID 30131946
1-ethyl-3-[1-(2-methoxyethyl)indol-3-yl]-1-(2-methylphenyl)urea
CID 40519863
N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228165
1-[1-(2-methoxyethyl)indol-3-yl]-3-(2,4,6-trimethylphenyl)urea
CID 18582507
N-(1-ethylindol-3-yl)-2,6-dimethylmorpholine-4-carboxamide
CID 18582367

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea?
The IUPAC name of 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea (CID 40519720) is 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea.
What is the SMILES notation for 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea?
The canonical SMILES for 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea is CCn1cc(NC(=O)Nc2cccc(C)c2C)c2ccccc21.
What is the InChIKey of 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea?
The InChIKey is MFENDSAVAPAVTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O/c1-4-22-12-17(15-9-5-6-11-18(15)22)21-19(23)20-16-10-7-8-13(2)14(16)3/h5-12H,4H2,1-3H3,(H2,20,21,23).
What are the key properties of 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea?
1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea has a molecular weight of 307.40 g/mol, XLogP of 4.92, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylphenyl)-3-(1-ethylindol-3-yl)urea is sourced from PubChem (CID 40519720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).