2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide

C14H20N2O2 — CID 116677580

IUPAC2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide
SMILESCOc1cccc(N(C)C(=O)C(C)C2CNC2)c1
InChIInChI=1S/C14H20N2O2/c1-10(11-8-15-9-11)14(17)16(2)12-5-4-6-13(7-12)18-3/h4-7,10-11,15H,8-9H2,1-3H3
InChIKeyYNCMNQZISFEKSI-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.51
Rot. Bonds4

About 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide

2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide (PubChem CID 116677580) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide
PubChem CID116677580
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide
SMILESCOc1cccc(N(C)C(=O)C(C)C2CNC2)c1
InChIInChI=1S/C14H20N2O2/c1-10(11-8-15-9-11)14(17)16(2)12-5-4-6-13(7-12)18-3/h4-7,10-11,15H,8-9H2,1-3H3
InChIKeyYNCMNQZISFEKSI-UHFFFAOYSA-N
XLogP1.51
TPSA41.57 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 ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S,4S)-N-(3-methoxyphenyl)-N,4-dimethylpyrrolidine-3-carboxamide
CID 114084877
propan-2-yl N-(3-methoxyphenyl)-N-methylcarbamate
CID 116655313
1-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methyltriazole-4-carboxamide
CID 79318707
2-cyano-N-(3-methoxyphenyl)-N,3-dimethylbutanamide
CID 62002443
(3R)-N-(3-methoxyphenyl)-N-methylpiperidine-3-carboxamide
CID 81140173
4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
CID 23508483
2-(3-methoxyphenoxy)-N-methyl-N-phenylpropanamide
CID 43916072
3-[[(3-methoxyphenyl)-methylcarbamoyl]amino]-2-methylpropanoic acid
CID 55105416
2-hydroxy-N-(3-methoxyphenyl)-N-methylacetamide
CID 70581132
4-[(3-methoxyphenyl)-methylcarbamoyl]benzoic acid
CID 62003468
3-amino-N-(3-methoxyphenyl)-N,2,2,3-tetramethylbutanamide
CID 65267204
(2S)-2-amino-N-(3-methoxyphenyl)-N-methylhexanamide
CID 107145312

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide (CID 116677580) is 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide is COc1cccc(N(C)C(=O)C(C)C2CNC2)c1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide?
The InChIKey is YNCMNQZISFEKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(11-8-15-9-11)14(17)16(2)12-5-4-6-13(7-12)18-3/h4-7,10-11,15H,8-9H2,1-3H3.
What are the key properties of 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide?
2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide has a molecular weight of 248.33 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(3-methoxyphenyl)-N-methylpropanamide is sourced from PubChem (CID 116677580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).