1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea

C18H20N2O — CID 23795651

IUPAC1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea
SMILESCc1ccc(C)c(NC(=O)NC2Cc3ccccc3C2)c1
InChIInChI=1S/C18H20N2O/c1-12-7-8-13(2)17(9-12)20-18(21)19-16-10-14-5-3-4-6-15(14)11-16/h3-9,16H,10-11H2,1-2H3,(H2,19,20,21)
InChIKeyVQEKBOCGMMPWAE-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.59
Rot. Bonds2

About 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea

1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea (PubChem CID 23795651) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea
PubChem CID23795651
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea
SMILESCc1ccc(C)c(NC(=O)NC2Cc3ccccc3C2)c1
InChIInChI=1S/C18H20N2O/c1-12-7-8-13(2)17(9-12)20-18(21)19-16-10-14-5-3-4-6-15(14)11-16/h3-9,16H,10-11H2,1-2H3,(H2,19,20,21)
InChIKeyVQEKBOCGMMPWAE-UHFFFAOYSA-N
XLogP3.59
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)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-(2,5-dimethylphenyl)-3-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]urea
CID 51094079
N-(2,5-dimethylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112520843
1-(2,5-dimethylphenyl)-3-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]urea
CID 7513500
N-(2,3-dihydro-1H-inden-2-yl)-2-hydroxy-5-methylbenzamide
CID 104693636
methyl (2S,4R)-4-[(2,5-dimethylphenyl)carbamoylamino]-1-methylpyrrolidine-2-carboxylate
CID 50976126
1-(2,5-dimethylphenyl)-3-(2-hydroxycyclohexyl)urea
CID 75948752
1-(2,3-dihydro-1H-inden-2-yl)-3-(2-methyl-6-propan-2-ylphenyl)urea
CID 5008117
1-(2,5-dimethylphenyl)-3-[1-(3-hydroxyphenyl)piperidin-4-yl]urea
CID 168974043
1-(2,5-dimethylphenyl)-3-(5-phenylpyrazolidin-3-yl)urea
CID 74640578
ethyl 2-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)benzoate
CID 3679782
1-(2,5-dimethylphenyl)-3-(2-ethylphenyl)urea
CID 17270131
1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea
CID 23934831

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea?
The IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea (CID 23795651) is 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea is Cc1ccc(C)c(NC(=O)NC2Cc3ccccc3C2)c1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea?
The InChIKey is VQEKBOCGMMPWAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-12-7-8-13(2)17(9-12)20-18(21)19-16-10-14-5-3-4-6-15(14)11-16/h3-9,16H,10-11H2,1-2H3,(H2,19,20,21).
What are the key properties of 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea?
1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea has a molecular weight of 280.37 g/mol, XLogP of 3.59, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea is sourced from PubChem (CID 23795651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).