1-(2-ethoxyphenyl)-3-pyridin-2-ylurea

C14H15N3O2 — CID 6466207

IUPAC1-(2-ethoxyphenyl)-3-pyridin-2-ylurea
SMILESCCOc1ccccc1NC(=O)Nc1ccccn1
InChIInChI=1S/C14H15N3O2/c1-2-19-12-8-4-3-7-11(12)16-14(18)17-13-9-5-6-10-15-13/h3-10H,2H2,1H3,(H2,15,16,17,18)
InChIKeyVKMXXPIOECZNAH-UHFFFAOYSA-N
MW257.29 g/mol
LogP3.12
Rot. Bonds4

About 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea

1-(2-ethoxyphenyl)-3-pyridin-2-ylurea (PubChem CID 6466207) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-3-pyridin-2-ylurea
PubChem CID6466207
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name1-(2-ethoxyphenyl)-3-pyridin-2-ylurea
SMILESCCOc1ccccc1NC(=O)Nc1ccccn1
InChIInChI=1S/C14H15N3O2/c1-2-19-12-8-4-3-7-11(12)16-14(18)17-13-9-5-6-10-15-13/h3-10H,2H2,1H3,(H2,15,16,17,18)
InChIKeyVKMXXPIOECZNAH-UHFFFAOYSA-N
XLogP3.12
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea?
The IUPAC name of 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea (CID 6466207) is 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea.
What is the SMILES notation for 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea?
The canonical SMILES for 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea is CCOc1ccccc1NC(=O)Nc1ccccn1.
What is the InChIKey of 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea?
The InChIKey is VKMXXPIOECZNAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-2-19-12-8-4-3-7-11(12)16-14(18)17-13-9-5-6-10-15-13/h3-10H,2H2,1H3,(H2,15,16,17,18).
What are the key properties of 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea?
1-(2-ethoxyphenyl)-3-pyridin-2-ylurea has a molecular weight of 257.29 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-3-pyridin-2-ylurea is sourced from PubChem (CID 6466207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).