2-(azetidin-1-yl)-N-methoxy-N-methylacetamide

C7H14N2O2 — CID 131222770

IUPAC2-(azetidin-1-yl)-N-methoxy-N-methylacetamide
SMILESCON(C)C(=O)CN1CCC1
InChIInChI=1S/C7H14N2O2/c1-8(11-2)7(10)6-9-4-3-5-9/h3-6H2,1-2H3
InChIKeyJSNCRRLHKIRUHR-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.29
Rot. Bonds3

About 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide

2-(azetidin-1-yl)-N-methoxy-N-methylacetamide (PubChem CID 131222770) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide.

Molecular Properties

Compound Name2-(azetidin-1-yl)-N-methoxy-N-methylacetamide
PubChem CID131222770
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name2-(azetidin-1-yl)-N-methoxy-N-methylacetamide
SMILESCON(C)C(=O)CN1CCC1
InChIInChI=1S/C7H14N2O2/c1-8(11-2)7(10)6-9-4-3-5-9/h3-6H2,1-2H3
InChIKeyJSNCRRLHKIRUHR-UHFFFAOYSA-N
XLogP-0.29
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(azetidin-1-yl)-N,N-dimethylacetamide
CID 69256971
N-methoxy-N-methyl-2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 54306558
2-[4-[[3-(fluoromethyl)phenyl]methyl]piperazin-1-yl]-N-methoxy-N-methylacetamide
CID 54288114
2-(4-acetyl-1,4-diazepan-1-yl)-N,N-dimethylacetamide
CID 60699636
2-[4-[2-[ethyl(methyl)amino]-2-oxoethyl]-1,4-diazepan-1-yl]acetic acid
CID 62822911
N-methoxy-N-methylpropanamide
CID 11344007
N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane
CID 142367549
2-[4-(3-methoxy-2,2-dimethylpropanoyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 154751160
2-[4-(5-hydroxypentyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 110923804
2-cyclopentyl-N-methoxy-N-methylacetamide
CID 15158208
2-[4-[(2R)-2-hydroxybutyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 111487415
N-(3-aminopropyl)-2-(azepan-1-yl)-N-methylacetamide
CID 43253394

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide?
The IUPAC name of 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide (CID 131222770) is 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide.
What is the SMILES notation for 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide?
The canonical SMILES for 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide is CON(C)C(=O)CN1CCC1.
What is the InChIKey of 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide?
The InChIKey is JSNCRRLHKIRUHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-8(11-2)7(10)6-9-4-3-5-9/h3-6H2,1-2H3.
What are the key properties of 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide?
2-(azetidin-1-yl)-N-methoxy-N-methylacetamide has a molecular weight of 158.20 g/mol, XLogP of -0.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)-N-methoxy-N-methylacetamide is sourced from PubChem (CID 131222770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).