1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea

C21H20N2O3 — CID 18407217

IUPAC1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea
SMILESCOc1ccccc1CN(C(N)=O)c1ccccc1Oc1ccccc1
InChIInChI=1S/C21H20N2O3/c1-25-19-13-7-5-9-16(19)15-23(21(22)24)18-12-6-8-14-20(18)26-17-10-3-2-4-11-17/h2-14H,15H2,1H3,(H2,22,24)
InChIKeyIWFTVCUCXPXZQD-UHFFFAOYSA-N
MW348.40 g/mol
LogP4.57
Rot. Bonds6

About 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea

1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea (PubChem CID 18407217) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea.

Molecular Properties

Compound Name1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea
PubChem CID18407217
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC Name1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea
SMILESCOc1ccccc1CN(C(N)=O)c1ccccc1Oc1ccccc1
InChIInChI=1S/C21H20N2O3/c1-25-19-13-7-5-9-16(19)15-23(21(22)24)18-12-6-8-14-20(18)26-17-10-3-2-4-11-17/h2-14H,15H2,1H3,(H2,22,24)
InChIKeyIWFTVCUCXPXZQD-UHFFFAOYSA-N
XLogP4.57
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,3-dimethoxyphenyl)methyl]-N-(2-phenoxyphenyl)acetamide
CID 71198512
(111C)methyl 2-[(N-acetyl-2-phenoxyanilino)methyl]benzoate
CID 11624963
N-(5-amino-2-phenoxyphenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
CID 71470709
N-(2-phenoxyphenyl)-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
CID 18407202
hydron;1-(2-methoxyphenyl)-1-(2-methylpropyl)urea
CID 174379543
3-[(2-methoxyphenyl)methyl-methylamino]propanamide
CID 27095531
N-benzyl-2-bromo-N-(2-phenoxyphenyl)acetamide
CID 71490575
N-(5-chloro-2-phenoxyphenyl)-N-[(2,5-dimethoxyphenyl)methyl]-2-fluoroacetamide
CID 122591164
3-[(2-methoxyphenyl)methyl-methylamino]-3-oxopropanoic acid
CID 62232246
1-methyl-1-[(2-phenoxyphenyl)methyl]guanidine
CID 121451349
(2R)-2-(2-methoxyphenoxy)-3-(2-phenoxyphenyl)propanoic acid
CID 100551442
N-acetyl-N-[(2-methoxyphenyl)methyl]acetamide
CID 91715642

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea?
The IUPAC name of 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea (CID 18407217) is 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea.
What is the SMILES notation for 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea?
The canonical SMILES for 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea is COc1ccccc1CN(C(N)=O)c1ccccc1Oc1ccccc1.
What is the InChIKey of 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea?
The InChIKey is IWFTVCUCXPXZQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-25-19-13-7-5-9-16(19)15-23(21(22)24)18-12-6-8-14-20(18)26-17-10-3-2-4-11-17/h2-14H,15H2,1H3,(H2,22,24).
What are the key properties of 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea?
1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea has a molecular weight of 348.40 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methoxyphenyl)methyl]-1-(2-phenoxyphenyl)urea is sourced from PubChem (CID 18407217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).