1-cyclopropyl-1-(oxetan-3-yl)urea

C7H12N2O2 — CID 176909139

IUPAC1-cyclopropyl-1-(oxetan-3-yl)urea
SMILESNC(=O)N(C1CC1)C1COC1
InChIInChI=1S/C7H12N2O2/c8-7(10)9(5-1-2-5)6-3-11-4-6/h5-6H,1-4H2,(H2,8,10)
InChIKeyWENGGBDEUILZAE-UHFFFAOYSA-N
MW156.18 g/mol
LogP-0.07
Rot. Bonds2

About 1-cyclopropyl-1-(oxetan-3-yl)urea

1-cyclopropyl-1-(oxetan-3-yl)urea (PubChem CID 176909139) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is 1-cyclopropyl-1-(oxetan-3-yl)urea.

Molecular Properties

Compound Name1-cyclopropyl-1-(oxetan-3-yl)urea
PubChem CID176909139
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC Name1-cyclopropyl-1-(oxetan-3-yl)urea
SMILESNC(=O)N(C1CC1)C1COC1
InChIInChI=1S/C7H12N2O2/c8-7(10)9(5-1-2-5)6-3-11-4-6/h5-6H,1-4H2,(H2,8,10)
InChIKeyWENGGBDEUILZAE-UHFFFAOYSA-N
XLogP-0.07
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(oxetan-3-yl)urea?
The IUPAC name of 1-cyclopropyl-1-(oxetan-3-yl)urea (CID 176909139) is 1-cyclopropyl-1-(oxetan-3-yl)urea.
What is the SMILES notation for 1-cyclopropyl-1-(oxetan-3-yl)urea?
The canonical SMILES for 1-cyclopropyl-1-(oxetan-3-yl)urea is NC(=O)N(C1CC1)C1COC1.
What is the InChIKey of 1-cyclopropyl-1-(oxetan-3-yl)urea?
The InChIKey is WENGGBDEUILZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c8-7(10)9(5-1-2-5)6-3-11-4-6/h5-6H,1-4H2,(H2,8,10).
What are the key properties of 1-cyclopropyl-1-(oxetan-3-yl)urea?
1-cyclopropyl-1-(oxetan-3-yl)urea has a molecular weight of 156.18 g/mol, XLogP of -0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(oxetan-3-yl)urea is sourced from PubChem (CID 176909139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).