(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone

C14H23NO2 — CID 66475400

IUPAC(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
SMILESCC1(C)C(C(=O)N2CC(O)(C3CC3)C2)C1(C)C
InChIInChI=1S/C14H23NO2/c1-12(2)10(13(12,3)4)11(16)15-7-14(17,8-15)9-5-6-9/h9-10,17H,5-8H2,1-4H3
InChIKeyAONHITANBKIQQP-UHFFFAOYSA-N
MW237.34 g/mol
LogP1.65
Rot. Bonds2

About (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone

(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone (PubChem CID 66475400) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone.

Molecular Properties

Compound Name(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
PubChem CID66475400
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
SMILESCC1(C)C(C(=O)N2CC(O)(C3CC3)C2)C1(C)C
InChIInChI=1S/C14H23NO2/c1-12(2)10(13(12,3)4)11(16)15-7-14(17,8-15)9-5-6-9/h9-10,17H,5-8H2,1-4H3
InChIKeyAONHITANBKIQQP-UHFFFAOYSA-N
XLogP1.65
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone?
The IUPAC name of (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone (CID 66475400) is (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone.
What is the SMILES notation for (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone?
The canonical SMILES for (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone is CC1(C)C(C(=O)N2CC(O)(C3CC3)C2)C1(C)C.
What is the InChIKey of (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone?
The InChIKey is AONHITANBKIQQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-12(2)10(13(12,3)4)11(16)15-7-14(17,8-15)9-5-6-9/h9-10,17H,5-8H2,1-4H3.
What are the key properties of (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone?
(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone has a molecular weight of 237.34 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone is sourced from PubChem (CID 66475400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).