1-(4-methoxyphenyl)-1,3-dimethylurea

C10H14N2O2 — CID 116655338

IUPAC1-(4-methoxyphenyl)-1,3-dimethylurea
SMILESCNC(=O)N(C)c1ccc(OC)cc1
InChIInChI=1S/C10H14N2O2/c1-11-10(13)12(2)8-4-6-9(14-3)7-5-8/h4-7H,1-3H3,(H,11,13)
InChIKeyAUQRLSULBLVYBC-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.47
Rot. Bonds2

About 1-(4-methoxyphenyl)-1,3-dimethylurea

1-(4-methoxyphenyl)-1,3-dimethylurea (PubChem CID 116655338) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-1,3-dimethylurea.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-1,3-dimethylurea
PubChem CID116655338
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name1-(4-methoxyphenyl)-1,3-dimethylurea
SMILESCNC(=O)N(C)c1ccc(OC)cc1
InChIInChI=1S/C10H14N2O2/c1-11-10(13)12(2)8-4-6-9(14-3)7-5-8/h4-7H,1-3H3,(H,11,13)
InChIKeyAUQRLSULBLVYBC-UHFFFAOYSA-N
XLogP1.47
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dimethyl-1-(4-propan-2-yloxyphenyl)urea
CID 115169003
(4-methoxyphenyl)-methylcarbamic acid
CID 22047987
1-(4-hydroxyphenyl)-1,3-dimethylurea
CID 115281222
(2S)-2-[[(4-methoxyphenyl)-methylcarbamoyl]amino]propanoic acid
CID 62002877
1-[(4-methoxyphenyl)methyl]-1,3-dimethylurea
CID 115575178
(2S)-3-hydroxy-2-[[(4-methoxyphenyl)-methylcarbamoyl]amino]propanoic acid
CID 62001547
3-[[(4-methoxyphenyl)-methylcarbamoyl]amino]-3-methylbutanoic acid
CID 64699727
1-(3-fluoro-4-methoxyphenyl)-1,3-dimethylurea
CID 115168962
2-chloro-N-(4-methoxyphenyl)-N-methylacetamide
CID 4714233
[4-[methyl(propan-2-ylcarbamoyl)amino]phenyl] 2-(4-methoxyphenoxy)acetate
CID 55750862
(2S)-2-[[(4-methoxyphenyl)-methylcarbamoyl]amino]-3-methylpentanoic acid
CID 62001738
3-methoxy-4-[[(4-methoxyphenyl)-methylcarbamoyl]amino]butanoic acid
CID 103159199

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-1,3-dimethylurea?
The IUPAC name of 1-(4-methoxyphenyl)-1,3-dimethylurea (CID 116655338) is 1-(4-methoxyphenyl)-1,3-dimethylurea.
What is the SMILES notation for 1-(4-methoxyphenyl)-1,3-dimethylurea?
The canonical SMILES for 1-(4-methoxyphenyl)-1,3-dimethylurea is CNC(=O)N(C)c1ccc(OC)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-1,3-dimethylurea?
The InChIKey is AUQRLSULBLVYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-11-10(13)12(2)8-4-6-9(14-3)7-5-8/h4-7H,1-3H3,(H,11,13).
What are the key properties of 1-(4-methoxyphenyl)-1,3-dimethylurea?
1-(4-methoxyphenyl)-1,3-dimethylurea has a molecular weight of 194.23 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-1,3-dimethylurea is sourced from PubChem (CID 116655338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).