N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide

C13H23N3O3 — CID 64611592

IUPACN-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1CCN(C(=O)CC2CNC2)CC1
InChIInChI=1S/C13H23N3O3/c1-19-9-12(17)15-11-2-4-16(5-3-11)13(18)6-10-7-14-8-10/h10-11,14H,2-9H2,1H3,(H,15,17)
InChIKeyJMHQNJLICAGSDK-UHFFFAOYSA-N
MW269.34 g/mol
LogP-0.65
Rot. Bonds5

About N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide

N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide (PubChem CID 64611592) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide
PubChem CID64611592
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC NameN-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1CCN(C(=O)CC2CNC2)CC1
InChIInChI=1S/C13H23N3O3/c1-19-9-12(17)15-11-2-4-16(5-3-11)13(18)6-10-7-14-8-10/h10-11,14H,2-9H2,1H3,(H,15,17)
InChIKeyJMHQNJLICAGSDK-UHFFFAOYSA-N
XLogP-0.65
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2-bromoacetyl)piperidin-4-yl]-2-methoxyacetamide
CID 63680285
N-(azetidin-3-yl)-2-methoxyacetamide
CID 55299715
4-[4-[(2-methoxyacetyl)amino]piperidin-1-yl]-4-oxobutanoic acid
CID 54875415
methyl 1-[2-(azetidin-3-yl)acetyl]piperidine-4-carboxylate
CID 64617361
N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]-2-methoxyacetamide
CID 65466624
2-methoxy-N-[1-(2-thiomorpholin-3-ylacetyl)piperidin-4-yl]acetamide
CID 66422654
N-[1-(4-aminobutanoyl)piperidin-4-yl]-2-methoxyacetamide
CID 54872286
N-[1-(5-bromopentanoyl)piperidin-4-yl]-2-methoxyacetamide
CID 114014853
2-bromo-N-[1-(2-methoxyacetyl)piperidin-4-yl]acetamide
CID 63681407
N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]ethanesulfonamide
CID 64610162
N,N-diethyl-4-[(2-methoxyacetyl)amino]piperidine-1-carboxamide
CID 108562550
N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide
CID 61265439

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide?
The IUPAC name of N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide (CID 64611592) is N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide?
The canonical SMILES for N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide is COCC(=O)NC1CCN(C(=O)CC2CNC2)CC1.
What is the InChIKey of N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide?
The InChIKey is JMHQNJLICAGSDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c1-19-9-12(17)15-11-2-4-16(5-3-11)13(18)6-10-7-14-8-10/h10-11,14H,2-9H2,1H3,(H,15,17).
What are the key properties of N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide?
N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide has a molecular weight of 269.34 g/mol, XLogP of -0.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide is sourced from PubChem (CID 64611592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).