1-(2-methoxyphenyl)-3-naphthalen-1-ylurea

C18H16N2O2 — CID 768067

IUPAC1-(2-methoxyphenyl)-3-naphthalen-1-ylurea
SMILESCOc1ccccc1NC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C18H16N2O2/c1-22-17-12-5-4-10-16(17)20-18(21)19-15-11-6-8-13-7-2-3-9-14(13)15/h2-12H,1H3,(H2,19,20,21)
InChIKeyFWEMUPBSFQCOSI-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.49
Rot. Bonds3

About 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea

1-(2-methoxyphenyl)-3-naphthalen-1-ylurea (PubChem CID 768067) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-3-naphthalen-1-ylurea
PubChem CID768067
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name1-(2-methoxyphenyl)-3-naphthalen-1-ylurea
SMILESCOc1ccccc1NC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C18H16N2O2/c1-22-17-12-5-4-10-16(17)20-18(21)19-15-11-6-8-13-7-2-3-9-14(13)15/h2-12H,1H3,(H2,19,20,21)
InChIKeyFWEMUPBSFQCOSI-UHFFFAOYSA-N
XLogP4.49
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea?
The IUPAC name of 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea (CID 768067) is 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea.
What is the SMILES notation for 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea?
The canonical SMILES for 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea is COc1ccccc1NC(=O)Nc1cccc2ccccc12.
What is the InChIKey of 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea?
The InChIKey is FWEMUPBSFQCOSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-22-17-12-5-4-10-16(17)20-18(21)19-15-11-6-8-13-7-2-3-9-14(13)15/h2-12H,1H3,(H2,19,20,21).
What are the key properties of 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea?
1-(2-methoxyphenyl)-3-naphthalen-1-ylurea has a molecular weight of 292.34 g/mol, XLogP of 4.49, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-3-naphthalen-1-ylurea is sourced from PubChem (CID 768067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).