2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide

C15H23N3O2 — CID 66216109

IUPAC2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCCCN(CC(=O)Nc1ccccc1OC)C1CNC1
InChIInChI=1S/C15H23N3O2/c1-3-8-18(12-9-16-10-12)11-15(19)17-13-6-4-5-7-14(13)20-2/h4-7,12,16H,3,8-11H2,1-2H3,(H,17,19)
InChIKeyOJEJLDPFEWPDDV-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.32
Rot. Bonds7

About 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide

2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide (PubChem CID 66216109) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide
PubChem CID66216109
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCCCN(CC(=O)Nc1ccccc1OC)C1CNC1
InChIInChI=1S/C15H23N3O2/c1-3-8-18(12-9-16-10-12)11-15(19)17-13-6-4-5-7-14(13)20-2/h4-7,12,16H,3,8-11H2,1-2H3,(H,17,19)
InChIKeyOJEJLDPFEWPDDV-UHFFFAOYSA-N
XLogP1.32
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide (CID 66216109) is 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide is CCCN(CC(=O)Nc1ccccc1OC)C1CNC1.
What is the InChIKey of 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is OJEJLDPFEWPDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-8-18(12-9-16-10-12)11-15(19)17-13-6-4-5-7-14(13)20-2/h4-7,12,16H,3,8-11H2,1-2H3,(H,17,19).
What are the key properties of 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide?
2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.32, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 66216109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).