2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide

C14H20N2O2 — CID 66196031

IUPAC2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(C(C)NC(=O)CC2CNC2)cc1
InChIInChI=1S/C14H20N2O2/c1-10(12-3-5-13(18-2)6-4-12)16-14(17)7-11-8-15-9-11/h3-6,10-11,15H,7-9H2,1-2H3,(H,16,17)
InChIKeyJRVJVOYYUHIBFQ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.48
Rot. Bonds5

About 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide

2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide (PubChem CID 66196031) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
PubChem CID66196031
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(C(C)NC(=O)CC2CNC2)cc1
InChIInChI=1S/C14H20N2O2/c1-10(12-3-5-13(18-2)6-4-12)16-14(17)7-11-8-15-9-11/h3-6,10-11,15H,7-9H2,1-2H3,(H,16,17)
InChIKeyJRVJVOYYUHIBFQ-UHFFFAOYSA-N
XLogP1.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yl)-N-(1-pyridin-4-ylethyl)acetamide
CID 64616162
2-(azetidin-3-yl)-N-[(1R)-1-pyridin-4-ylethyl]acetamide
CID 81409827
N-[1-(4-methoxyphenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 66195074
2-(4-methoxyphenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 94843836
2-amino-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81364080
2-bromo-N-[(1S)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81370298
2-(2-methoxyethylamino)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81364417
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide
CID 81368842
N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide
CID 81356926
N-[1-(4-methoxyphenyl)ethyl]azetidin-3-amine
CID 66244684
N-[(1R)-1-(4-fluorophenyl)ethyl]-2-(4-methoxyphenyl)acetamide
CID 2713156
1-(methoxymethyl)-3-[1-(4-methoxyphenyl)ethyl]urea
CID 108893562

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide (CID 66196031) is 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide is COc1ccc(C(C)NC(=O)CC2CNC2)cc1.
What is the InChIKey of 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide?
The InChIKey is JRVJVOYYUHIBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(12-3-5-13(18-2)6-4-12)16-14(17)7-11-8-15-9-11/h3-6,10-11,15H,7-9H2,1-2H3,(H,16,17).
What are the key properties of 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide?
2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 66196031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).