1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea

C17H17N3O2 — CID 165032676

IUPAC1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea
SMILESC=C1Cc2cc(NC(=O)Nc3ccccc3OC)ccc2N1
InChIInChI=1S/C17H17N3O2/c1-11-9-12-10-13(7-8-14(12)18-11)19-17(21)20-15-5-3-4-6-16(15)22-2/h3-8,10,18H,1,9H2,2H3,(H2,19,20,21)
InChIKeyIJANCQDDIBYLGY-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.82
Rot. Bonds3

About 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea

1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea (PubChem CID 165032676) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea
PubChem CID165032676
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea
SMILESC=C1Cc2cc(NC(=O)Nc3ccccc3OC)ccc2N1
InChIInChI=1S/C17H17N3O2/c1-11-9-12-10-13(7-8-14(12)18-11)19-17(21)20-15-5-3-4-6-16(15)22-2/h3-8,10,18H,1,9H2,2H3,(H2,19,20,21)
InChIKeyIJANCQDDIBYLGY-UHFFFAOYSA-N
XLogP3.82
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-chloro-2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea
CID 164995558
1-(2,3-dihydro-1H-indol-5-yl)-3-(2-methoxyphenyl)urea
CID 63252912
1-(4-fluorophenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea
CID 164953050
1-(2,4-dimethoxyphenyl)-3-(2-oxo-1,3-dihydroindol-5-yl)urea
CID 30375576
1-(2,5-dimethoxyphenyl)-3-(2-oxo-1,3-dihydroindol-5-yl)urea
CID 155113917
CID 168763596
CID 168763596
1-(3-amino-4-methoxyphenyl)-3-(2-methoxyphenyl)urea
CID 43602334
1-(3,5-dimethoxyphenyl)-3-(2-oxo-1,3-dihydroindol-5-yl)urea
CID 30375542
4-[(2-methoxyphenyl)carbamoylamino]benzoic acid
CID 853793
1-(2,3-dihydro-1H-indol-4-yl)-3-(2-methoxyphenyl)urea
CID 66613515
1-(3-cyano-4-fluorophenyl)-3-(2-methoxyphenyl)urea
CID 62315446
1-(2-methoxyphenyl)-3-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)urea
CID 100536950

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea?
The IUPAC name of 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea (CID 165032676) is 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea.
What is the SMILES notation for 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea?
The canonical SMILES for 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea is C=C1Cc2cc(NC(=O)Nc3ccccc3OC)ccc2N1.
What is the InChIKey of 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea?
The InChIKey is IJANCQDDIBYLGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-11-9-12-10-13(7-8-14(12)18-11)19-17(21)20-15-5-3-4-6-16(15)22-2/h3-8,10,18H,1,9H2,2H3,(H2,19,20,21).
What are the key properties of 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea?
1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea has a molecular weight of 295.34 g/mol, XLogP of 3.82, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-3-(2-methylidene-1,3-dihydroindol-5-yl)urea is sourced from PubChem (CID 165032676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).