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

C18H20N2O2 — CID 17282409

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea
SMILESCOc1ccc(C)cc1NC(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C18H20N2O2/c1-12-6-9-17(22-2)16(10-12)20-18(21)19-15-8-7-13-4-3-5-14(13)11-15/h6-11H,3-5H2,1-2H3,(H2,19,20,21)
InChIKeySBOFJNZVSKNTDH-UHFFFAOYSA-N
MW296.37 g/mol
LogP4.14
Rot. Bonds3

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

1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea (PubChem CID 17282409) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea
PubChem CID17282409
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea
SMILESCOc1ccc(C)cc1NC(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C18H20N2O2/c1-12-6-9-17(22-2)16(10-12)20-18(21)19-15-8-7-13-4-3-5-14(13)11-15/h6-11H,3-5H2,1-2H3,(H2,19,20,21)
InChIKeySBOFJNZVSKNTDH-UHFFFAOYSA-N
XLogP4.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-Methoxyphenyl)-3-naphthalen-2-ylurea
CID 443080
1-(2-Methoxyphenyl)-3-naphthalen-1-ylurea
CID 768067
1-(2-Methoxy-5-methylphenyl)-3-[4-(sulfamoylamino)phenyl]urea
CID 71273629
N-(2-methoxyphenyl)-N'-(2-phenylethyl)urea
CID 853786
1,1-Dibenzyl-3-(2-methoxy-5-methylphenyl)urea
CID 4167053
1-(2,3-dihydro-1H-inden-5-yl)-3-(3,4-dimethoxyphenyl)urea
CID 6465440
1-(2,3-dihydro-1H-inden-5-yl)-3-(2,4-dimethoxyphenyl)urea
CID 969986
N-[4-(cyanomethyl)phenyl]-N'-(2-methoxyphenyl)urea
CID 2811977
1-(2,3-dihydro-1H-inden-2-yl)-3-(2-ethoxyphenyl)urea
CID 2823456
1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxyphenyl)urea
CID 4827268
1-(2,3-dihydro-1H-inden-5-yl)-3-(2-ethoxyphenyl)urea
CID 17262229
N-(2,3-Dihydro-1H-inden-5-YL)-N'-(4-ethoxyphenyl)urea
CID 24818654

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea (CID 17282409) is 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea is COc1ccc(C)cc1NC(=O)Nc1ccc2c(c1)CCC2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea?
The InChIKey is SBOFJNZVSKNTDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-12-6-9-17(22-2)16(10-12)20-18(21)19-15-8-7-13-4-3-5-14(13)11-15/h6-11H,3-5H2,1-2H3,(H2,19,20,21).
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea?
1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea has a molecular weight of 296.37 g/mol, XLogP of 4.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-yl)-3-(2-methoxy-5-methylphenyl)urea is sourced from PubChem (CID 17282409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).