N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide

C16H23N3O2 — CID 66216125

IUPACN-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide
SMILESCCCN(CC(=O)NC(=O)Cc1ccccc1)C1CNC1
InChIInChI=1S/C16H23N3O2/c1-2-8-19(14-10-17-11-14)12-16(21)18-15(20)9-13-6-4-3-5-7-13/h3-7,14,17H,2,8-12H2,1H3,(H,18,20,21)
InChIKeyMXKPDOXEBKZUPI-UHFFFAOYSA-N
MW289.38 g/mol
LogP0.56
Rot. Bonds7

About N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide

N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide (PubChem CID 66216125) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide
PubChem CID66216125
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide
SMILESCCCN(CC(=O)NC(=O)Cc1ccccc1)C1CNC1
InChIInChI=1S/C16H23N3O2/c1-2-8-19(14-10-17-11-14)12-16(21)18-15(20)9-13-6-4-3-5-7-13/h3-7,14,17H,2,8-12H2,1H3,(H,18,20,21)
InChIKeyMXKPDOXEBKZUPI-UHFFFAOYSA-N
XLogP0.56
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-[2-[azetidin-3-yl(propyl)amino]acetyl]benzohydrazide
CID 66213702
2-[azetidin-3-yl(propyl)amino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 66216510
N-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]-2-phenylacetamide
CID 102870028
2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide
CID 66216109
2-[azetidin-3-yl(propyl)amino]-N-[(3-methoxyphenyl)methyl]acetamide
CID 66216515
2-[azetidin-3-yl(propyl)amino]-N-(4-fluorophenyl)acetamide
CID 66213900
2-[azetidin-3-yl(propyl)amino]-N-(tert-butylcarbamoyl)acetamide
CID 66216311
2-[azetidin-3-yl(propyl)amino]-N-cyclopropylacetamide
CID 66216105
2-[azetidin-3-yl(propyl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 66216307
N-(2-phenoxyethyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 119921645
2-[azetidin-3-yl(propyl)amino]-N-[1-(furan-2-yl)ethyl]acetamide
CID 66216723
2-[azetidin-3-yl(propyl)amino]-N-(5-bromo-2-pyridinyl)acetamide
CID 66214675

Frequently Asked Questions

What is the IUPAC name of N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide?
The IUPAC name of N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide (CID 66216125) is N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide is CCCN(CC(=O)NC(=O)Cc1ccccc1)C1CNC1.
What is the InChIKey of N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide?
The InChIKey is MXKPDOXEBKZUPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-2-8-19(14-10-17-11-14)12-16(21)18-15(20)9-13-6-4-3-5-7-13/h3-7,14,17H,2,8-12H2,1H3,(H,18,20,21).
What are the key properties of N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide?
N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide has a molecular weight of 289.38 g/mol, XLogP of 0.56, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[azetidin-3-yl(propyl)amino]acetyl]-2-phenylacetamide is sourced from PubChem (CID 66216125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).