1-methoxy-3-methyl-1-phenylmethoxyurea

C10H14N2O3 — CID 15933183

IUPAC1-methoxy-3-methyl-1-phenylmethoxyurea
SMILESCNC(=O)N(OC)OCc1ccccc1
InChIInChI=1S/C10H14N2O3/c1-11-10(13)12(14-2)15-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,11,13)
InChIKeyGVPVLJIJYGZWEI-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.32
Rot. Bonds4

About 1-methoxy-3-methyl-1-phenylmethoxyurea

1-methoxy-3-methyl-1-phenylmethoxyurea (PubChem CID 15933183) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 1-methoxy-3-methyl-1-phenylmethoxyurea.

Molecular Properties

Compound Name1-methoxy-3-methyl-1-phenylmethoxyurea
PubChem CID15933183
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name1-methoxy-3-methyl-1-phenylmethoxyurea
SMILESCNC(=O)N(OC)OCc1ccccc1
InChIInChI=1S/C10H14N2O3/c1-11-10(13)12(14-2)15-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,11,13)
InChIKeyGVPVLJIJYGZWEI-UHFFFAOYSA-N
XLogP1.32
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-oxo-N-phenyl-N-phenylmethoxybutanamide
CID 12589379
N-hydroxy-N-phenylmethoxyacetamide
CID 173249339
N-phenylmethoxyacetohydrazide
CID 174450270
methoxymethylbenzene;methyl acetate
CID 54330728
1-methyl-3-phenylmethoxyurea
CID 14227198
methyl 4-[phenylmethoxy(phenylmethoxycarbonyl)amino]benzoate
CID 166448168
3-[acetyl(phenylmethoxy)amino]propanoic acid
CID 10060062
methyl 3-[carbamoyl(phenylmethoxy)amino]propanoate
CID 119089437
benzyl N-(methoxycarbonylamino)carbamate
CID 71669783
acetic acid;phenylmethoxymethylbenzene
CID 175214238
N-(3-oxopropyl)-N-phenylmethoxyacetamide
CID 71545702
2-[methyl(phenylmethoxy)amino]-N-phenylacetamide
CID 71844467

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-methyl-1-phenylmethoxyurea?
The IUPAC name of 1-methoxy-3-methyl-1-phenylmethoxyurea (CID 15933183) is 1-methoxy-3-methyl-1-phenylmethoxyurea.
What is the SMILES notation for 1-methoxy-3-methyl-1-phenylmethoxyurea?
The canonical SMILES for 1-methoxy-3-methyl-1-phenylmethoxyurea is CNC(=O)N(OC)OCc1ccccc1.
What is the InChIKey of 1-methoxy-3-methyl-1-phenylmethoxyurea?
The InChIKey is GVPVLJIJYGZWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-11-10(13)12(14-2)15-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,11,13).
What are the key properties of 1-methoxy-3-methyl-1-phenylmethoxyurea?
1-methoxy-3-methyl-1-phenylmethoxyurea has a molecular weight of 210.23 g/mol, XLogP of 1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-methyl-1-phenylmethoxyurea is sourced from PubChem (CID 15933183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).