1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea

C19H24N2O2 — CID 112824956

IUPAC1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea
SMILESCCCc1ccc(NC(=O)NCC(OC)c2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-3-7-15-10-12-17(13-11-15)21-19(22)20-14-18(23-2)16-8-5-4-6-9-16/h4-6,8-13,18H,3,7,14H2,1-2H3,(H2,20,21,22)
InChIKeyOBXRJDOKAUEDKI-UHFFFAOYSA-N
MW312.41 g/mol
LogP4.15
Rot. Bonds7

About 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea

1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea (PubChem CID 112824956) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea.

Molecular Properties

Compound Name1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea
PubChem CID112824956
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea
SMILESCCCc1ccc(NC(=O)NCC(OC)c2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-3-7-15-10-12-17(13-11-15)21-19(22)20-14-18(23-2)16-8-5-4-6-9-16/h4-6,8-13,18H,3,7,14H2,1-2H3,(H2,20,21,22)
InChIKeyOBXRJDOKAUEDKI-UHFFFAOYSA-N
XLogP4.15
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylurea
CID 90623219
(2R)-N-(4-butylphenyl)-2-methoxy-2-phenylacetamide
CID 2207661
1-[2-(3-fluorophenyl)-2-methoxyethyl]-3-(4-methylphenyl)urea
CID 90623223
N-[2-methoxy-2-(2-methylphenyl)ethyl]-4-propylbenzamide
CID 90598713
1-(2-methoxy-2-phenylethyl)-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 47021762
2-amino-N-(2-methoxy-2-phenylethyl)pentanamide
CID 119278905
1-[2-methoxy-2-(5-methylthiophen-2-yl)ethyl]-3-phenylurea
CID 90598631
2-phenyl-N-(4-propylphenyl)acetamide
CID 126501660
1-(1,3-dihydro-2-benzofuran-5-yl)-3-[(2S)-2-ethoxy-2-phenylethyl]urea
CID 99839643
1-(3,5-dimethoxyphenyl)-3-[2-methoxy-2-(3-methoxyphenyl)ethyl]urea
CID 90623649
1-(2,2-diphenylethyl)-3-(4-propan-2-ylphenyl)urea
CID 3343783
1-(cyclobutylmethyl)-3-(4-propylphenyl)urea
CID 112824904

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea?
The IUPAC name of 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea (CID 112824956) is 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea.
What is the SMILES notation for 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea?
The canonical SMILES for 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea is CCCc1ccc(NC(=O)NCC(OC)c2ccccc2)cc1.
What is the InChIKey of 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea?
The InChIKey is OBXRJDOKAUEDKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-3-7-15-10-12-17(13-11-15)21-19(22)20-14-18(23-2)16-8-5-4-6-9-16/h4-6,8-13,18H,3,7,14H2,1-2H3,(H2,20,21,22).
What are the key properties of 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea?
1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea has a molecular weight of 312.41 g/mol, XLogP of 4.15, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-2-phenylethyl)-3-(4-propylphenyl)urea is sourced from PubChem (CID 112824956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).