3-hydroxy-1-phenylcyclobutane-1-carboxamide

C11H13NO2 — CID 131324650

IUPAC3-hydroxy-1-phenylcyclobutane-1-carboxamide
SMILESNC(=O)C1(c2ccccc2)CC(O)C1
InChIInChI=1S/C11H13NO2/c12-10(14)11(6-9(13)7-11)8-4-2-1-3-5-8/h1-5,9,13H,6-7H2,(H2,12,14)
InChIKeyJPOBZJHFJXBUTE-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.56
Rot. Bonds2

About 3-hydroxy-1-phenylcyclobutane-1-carboxamide

3-hydroxy-1-phenylcyclobutane-1-carboxamide (PubChem CID 131324650) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 3-hydroxy-1-phenylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name3-hydroxy-1-phenylcyclobutane-1-carboxamide
PubChem CID131324650
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name3-hydroxy-1-phenylcyclobutane-1-carboxamide
SMILESNC(=O)C1(c2ccccc2)CC(O)C1
InChIInChI=1S/C11H13NO2/c12-10(14)11(6-9(13)7-11)8-4-2-1-3-5-8/h1-5,9,13H,6-7H2,(H2,12,14)
InChIKeyJPOBZJHFJXBUTE-UHFFFAOYSA-N
XLogP0.56
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1-phenylcyclobutane-1-carboxamide?
The IUPAC name of 3-hydroxy-1-phenylcyclobutane-1-carboxamide (CID 131324650) is 3-hydroxy-1-phenylcyclobutane-1-carboxamide.
What is the SMILES notation for 3-hydroxy-1-phenylcyclobutane-1-carboxamide?
The canonical SMILES for 3-hydroxy-1-phenylcyclobutane-1-carboxamide is NC(=O)C1(c2ccccc2)CC(O)C1.
What is the InChIKey of 3-hydroxy-1-phenylcyclobutane-1-carboxamide?
The InChIKey is JPOBZJHFJXBUTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c12-10(14)11(6-9(13)7-11)8-4-2-1-3-5-8/h1-5,9,13H,6-7H2,(H2,12,14).
What are the key properties of 3-hydroxy-1-phenylcyclobutane-1-carboxamide?
3-hydroxy-1-phenylcyclobutane-1-carboxamide has a molecular weight of 191.23 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1-phenylcyclobutane-1-carboxamide is sourced from PubChem (CID 131324650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).