1-carbamoyl-3-(2-methoxyphenyl)urea

C9H11N3O3 — CID 762507

IUPAC1-carbamoyl-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)NC(N)=O
InChIInChI=1S/C9H11N3O3/c1-15-7-5-3-2-4-6(7)11-9(14)12-8(10)13/h2-5H,1H3,(H4,10,11,12,13,14)
InChIKeyVETUBRQUWHLUCO-UHFFFAOYSA-N
MW209.21 g/mol
LogP0.90
Rot. Bonds2

About 1-carbamoyl-3-(2-methoxyphenyl)urea

1-carbamoyl-3-(2-methoxyphenyl)urea (PubChem CID 762507) has the molecular formula C9H11N3O3 and a molecular weight of 209.21 g/mol. Its IUPAC name is 1-carbamoyl-3-(2-methoxyphenyl)urea.

Molecular Properties

Compound Name1-carbamoyl-3-(2-methoxyphenyl)urea
PubChem CID762507
Molecular FormulaC9H11N3O3
Molecular Weight209.21 g/mol
Exact Mass209.08
IUPAC Name1-carbamoyl-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)NC(N)=O
InChIInChI=1S/C9H11N3O3/c1-15-7-5-3-2-4-6(7)11-9(14)12-8(10)13/h2-5H,1H3,(H4,10,11,12,13,14)
InChIKeyVETUBRQUWHLUCO-UHFFFAOYSA-N
XLogP0.90
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-carbamoyl-3-(2-methoxyphenyl)urea?
The IUPAC name of 1-carbamoyl-3-(2-methoxyphenyl)urea (CID 762507) is 1-carbamoyl-3-(2-methoxyphenyl)urea.
What is the SMILES notation for 1-carbamoyl-3-(2-methoxyphenyl)urea?
The canonical SMILES for 1-carbamoyl-3-(2-methoxyphenyl)urea is COc1ccccc1NC(=O)NC(N)=O.
What is the InChIKey of 1-carbamoyl-3-(2-methoxyphenyl)urea?
The InChIKey is VETUBRQUWHLUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c1-15-7-5-3-2-4-6(7)11-9(14)12-8(10)13/h2-5H,1H3,(H4,10,11,12,13,14).
What are the key properties of 1-carbamoyl-3-(2-methoxyphenyl)urea?
1-carbamoyl-3-(2-methoxyphenyl)urea has a molecular weight of 209.21 g/mol, XLogP of 0.90, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbamoyl-3-(2-methoxyphenyl)urea is sourced from PubChem (CID 762507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).