1-cyclopropyl-3-(4-ethoxyphenyl)urea

C12H16N2O2 — CID 17264486

IUPAC1-cyclopropyl-3-(4-ethoxyphenyl)urea
SMILESCCOc1ccc(NC(=O)NC2CC2)cc1
InChIInChI=1S/C12H16N2O2/c1-2-16-11-7-5-10(6-8-11)14-12(15)13-9-3-4-9/h5-9H,2-4H2,1H3,(H2,13,14,15)
InChIKeyUETZIZMFHHKGES-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.37
Rot. Bonds4

About 1-cyclopropyl-3-(4-ethoxyphenyl)urea

1-cyclopropyl-3-(4-ethoxyphenyl)urea (PubChem CID 17264486) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 1-cyclopropyl-3-(4-ethoxyphenyl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(4-ethoxyphenyl)urea
PubChem CID17264486
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name1-cyclopropyl-3-(4-ethoxyphenyl)urea
SMILESCCOc1ccc(NC(=O)NC2CC2)cc1
InChIInChI=1S/C12H16N2O2/c1-2-16-11-7-5-10(6-8-11)14-12(15)13-9-3-4-9/h5-9H,2-4H2,1H3,(H2,13,14,15)
InChIKeyUETZIZMFHHKGES-UHFFFAOYSA-N
XLogP2.37
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethoxyphenyl)-3-(4-pyrimidin-2-yloxycyclohexyl)urea
CID 90633477
1-(4-ethoxyphenyl)-3-(oxolan-3-yl)urea
CID 115758908
1-cyclopentyl-3-(4-propoxyphenyl)urea
CID 110774502
1-N-cyclopropyl-4-N-(4-ethoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109144778
N-cyclopropyl-N'-(4-ethoxyphenyl)-2,2-dimethylpropanediamide
CID 108957501
1-cyclopropyl-3-(6-ethoxy-3-pyridinyl)urea
CID 115687753
1-cycloheptyl-3-[4-(2-methoxyethoxy)phenyl]urea
CID 47033897
1-cycloheptyl-3-(4-ethoxyphenyl)thiourea
CID 8627943
2-[4-(cyclopentylcarbamoylamino)phenoxy]acetic acid
CID 63772718
1-cyclopentyl-3-(3-ethoxyphenyl)urea
CID 47264657
1-(2-adamantyl)-3-(4-ethoxyphenyl)urea
CID 17283236
2-(cyclopropylamino)-N-(4-ethoxyphenyl)acetamide;hydrochloride
CID 18778020

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(4-ethoxyphenyl)urea?
The IUPAC name of 1-cyclopropyl-3-(4-ethoxyphenyl)urea (CID 17264486) is 1-cyclopropyl-3-(4-ethoxyphenyl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(4-ethoxyphenyl)urea?
The canonical SMILES for 1-cyclopropyl-3-(4-ethoxyphenyl)urea is CCOc1ccc(NC(=O)NC2CC2)cc1.
What is the InChIKey of 1-cyclopropyl-3-(4-ethoxyphenyl)urea?
The InChIKey is UETZIZMFHHKGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-2-16-11-7-5-10(6-8-11)14-12(15)13-9-3-4-9/h5-9H,2-4H2,1H3,(H2,13,14,15).
What are the key properties of 1-cyclopropyl-3-(4-ethoxyphenyl)urea?
1-cyclopropyl-3-(4-ethoxyphenyl)urea has a molecular weight of 220.27 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(4-ethoxyphenyl)urea is sourced from PubChem (CID 17264486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).