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

C9H18N2O2 — CID 63282746

IUPAC2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)CN1CC(O)C1
InChIInChI=1S/C9H18N2O2/c1-7(2)10(3)9(13)6-11-4-8(12)5-11/h7-8,12H,4-6H2,1-3H3
InChIKeyLETGSOMBVHMZMO-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.47
Rot. Bonds3

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

2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide (PubChem CID 63282746) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide
PubChem CID63282746
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)CN1CC(O)C1
InChIInChI=1S/C9H18N2O2/c1-7(2)10(3)9(13)6-11-4-8(12)5-11/h7-8,12H,4-6H2,1-3H3
InChIKeyLETGSOMBVHMZMO-UHFFFAOYSA-N
XLogP-0.47
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide
CID 63282516
2-[6-hydroxy-4-[2-[2-methylpropyl(propan-2-yl)amino]-2-oxoethyl]-1,4-diazepan-1-yl]-N-(2-methylpropyl)-N-propan-2-ylacetamide
CID 166195250
2-(4-cyanopiperidin-1-yl)-N-methyl-N-propan-2-ylacetamide
CID 48966293
propan-2-yl 2-(3-hydroxyazetidin-1-yl)acetate
CID 63282457
methyl 1-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
CID 60669971
2-(3-hydroxyazetidin-1-yl)acetic acid
CID 63282398
3-[1-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]piperidin-4-yl]propanoic acid
CID 62215678
N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide
CID 63848072
2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 63852740
2-[2-(aminomethyl)morpholin-4-yl]-N-methyl-N-propan-2-ylacetamide
CID 61337607
2-[(3R)-3-(4-ethylpiperazin-1-yl)pyrrolidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 97028839
2-[3-(2-aminoethyl)piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 63763892

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide (CID 63282746) is 2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide is CC(C)N(C)C(=O)CN1CC(O)C1.
What is the InChIKey of 2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide?
The InChIKey is LETGSOMBVHMZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-7(2)10(3)9(13)6-11-4-8(12)5-11/h7-8,12H,4-6H2,1-3H3.
What are the key properties of 2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide?
2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide has a molecular weight of 186.25 g/mol, XLogP of -0.47, 3 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-methyl-N-propan-2-ylacetamide is sourced from PubChem (CID 63282746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).