1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea

C10H15N3O3 — CID 47223034

IUPAC1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea
SMILESCOCCNC(=O)Nc1cccnc1OC
InChIInChI=1S/C10H15N3O3/c1-15-7-6-12-10(14)13-8-4-3-5-11-9(8)16-2/h3-5H,6-7H2,1-2H3,(H2,12,13,14)
InChIKeyWVVPZWMLJJCAID-UHFFFAOYSA-N
MW225.25 g/mol
LogP0.86
Rot. Bonds5

About 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea

1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea (PubChem CID 47223034) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea.

Molecular Properties

Compound Name1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea
PubChem CID47223034
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea
SMILESCOCCNC(=O)Nc1cccnc1OC
InChIInChI=1S/C10H15N3O3/c1-15-7-6-12-10(14)13-8-4-3-5-11-9(8)16-2/h3-5H,6-7H2,1-2H3,(H2,12,13,14)
InChIKeyWVVPZWMLJJCAID-UHFFFAOYSA-N
XLogP0.86
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-methoxy-3-pyridinyl)-3-prop-2-ynylurea
CID 47042553
1-[2-(benzenesulfonyl)ethyl]-3-(2-methoxy-3-pyridinyl)urea
CID 51085372
1-(2-methoxy-3-pyridinyl)-3-(2-methylpropyl)urea
CID 47042582
1-(4-methoxybutyl)-3-(2-phenoxy-3-pyridinyl)urea
CID 47041319
2-hydroxy-N-(2-methoxy-3-pyridinyl)acetamide
CID 126992524
1-(3-methylbutyl)-3-(2-propan-2-yloxy-3-pyridinyl)urea
CID 112831617
1-(2-methoxy-3-pyridinyl)-3-[(6-methyl-2-pyridinyl)methyl]urea
CID 47260319
1-(2-ethoxyphenyl)-3-(2-methoxyethyl)urea
CID 47032357
1-(2-methoxy-3-pyridinyl)-3-[(3-methyl-4-pyridinyl)methyl]urea
CID 126792773
1-(2-methoxy-3-pyridinyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea
CID 55744742
2-bromo-N-(2-methoxy-3-pyridinyl)butanamide
CID 62854131
1-(2-methoxy-3-pyridinyl)-3-pyrrolidin-1-ylurea
CID 100763708

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea?
The IUPAC name of 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea (CID 47223034) is 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea.
What is the SMILES notation for 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea?
The canonical SMILES for 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea is COCCNC(=O)Nc1cccnc1OC.
What is the InChIKey of 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea?
The InChIKey is WVVPZWMLJJCAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-15-7-6-12-10(14)13-8-4-3-5-11-9(8)16-2/h3-5H,6-7H2,1-2H3,(H2,12,13,14).
What are the key properties of 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea?
1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea has a molecular weight of 225.25 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea is sourced from PubChem (CID 47223034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).