2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide

C14H20N2O2 — CID 63282516

IUPAC2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)CN1CC(O)C1)c1ccccc1
InChIInChI=1S/C14H20N2O2/c1-11(2)16(12-6-4-3-5-7-12)14(18)10-15-8-13(17)9-15/h3-7,11,13,17H,8-10H2,1-2H3
InChIKeyPASVJUOLOCAQQF-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.10
Rot. Bonds4

About 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide

2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide (PubChem CID 63282516) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide
PubChem CID63282516
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)CN1CC(O)C1)c1ccccc1
InChIInChI=1S/C14H20N2O2/c1-11(2)16(12-6-4-3-5-7-12)14(18)10-15-8-13(17)9-15/h3-7,11,13,17H,8-10H2,1-2H3
InChIKeyPASVJUOLOCAQQF-UHFFFAOYSA-N
XLogP1.10
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-N-phenyl-N-propan-2-ylacetamide;hydrochloride
CID 120663653
2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide
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2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-phenyl-N-propan-2-ylacetamide
CID 26495597
N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide
CID 60549343
2-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]-N-phenyl-N-propan-2-ylacetamide
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2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-phenyl-N-propan-2-ylacetamide
CID 8592399
2-[(4S)-2,5-dioxo-4-propan-2-ylimidazolidin-1-yl]-N-phenyl-N-propan-2-ylacetamide
CID 51535172
2-[4-(4-ethyl-1,2,4-triazol-3-yl)piperidin-1-yl]-N-phenyl-N-propan-2-ylacetamide
CID 136515167
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-phenyl-N-propan-2-ylacetamide
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Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide (CID 63282516) is 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide is CC(C)N(C(=O)CN1CC(O)C1)c1ccccc1.
What is the InChIKey of 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide?
The InChIKey is PASVJUOLOCAQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-11(2)16(12-6-4-3-5-7-12)14(18)10-15-8-13(17)9-15/h3-7,11,13,17H,8-10H2,1-2H3.
What are the key properties of 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide?
2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide has a molecular weight of 248.33 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide is sourced from PubChem (CID 63282516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).