2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide

C12H23N3O — CID 63760720

IUPAC2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide
SMILESNC1CN(CC(=O)NC2CCCCCC2)C1
InChIInChI=1S/C12H23N3O/c13-10-7-15(8-10)9-12(16)14-11-5-3-1-2-4-6-11/h10-11H,1-9,13H2,(H,14,16)
InChIKeyOAWXTCHNGXOLEB-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.47
Rot. Bonds3

About 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide

2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide (PubChem CID 63760720) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide.

Molecular Properties

Compound Name2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide
PubChem CID63760720
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide
SMILESNC1CN(CC(=O)NC2CCCCCC2)C1
InChIInChI=1S/C12H23N3O/c13-10-7-15(8-10)9-12(16)14-11-5-3-1-2-4-6-11/h10-11H,1-9,13H2,(H,14,16)
InChIKeyOAWXTCHNGXOLEB-UHFFFAOYSA-N
XLogP0.47
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminoazetidin-1-yl)-N-(oxan-4-yl)acetamide
CID 63760722
N-cyclopentyl-2-(3-hydroxyazetidin-1-yl)acetamide
CID 63090926
2-[1-[2-(cycloheptylamino)-2-oxoethyl]azetidin-3-yl]acetic acid
CID 64616897
2-(3-aminopyrrolidin-1-yl)-N-cyclopropylacetamide
CID 62067111
N-cyclooctyl-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]acetamide
CID 2446989
N-cycloheptyl-2-(3,5-dimethylpiperazin-1-yl)acetamide;hydrochloride
CID 119924112
N-cyclohexyl-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60968203
2-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-N-cyclopentylacetamide
CID 60916989
2-(4-amino-3-ethylpiperidin-1-yl)-N-cycloheptylacetamide
CID 81458998
N-cyclohexyl-2-[(3S)-3-hydroxypiperidin-1-yl]acetamide
CID 107225773
2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride
CID 119915633
N-cyclopentyl-2-[(3R)-3-hydroxypyrrolidin-1-yl]acetamide
CID 78962574

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide?
The IUPAC name of 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide (CID 63760720) is 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide.
What is the SMILES notation for 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide?
The canonical SMILES for 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide is NC1CN(CC(=O)NC2CCCCCC2)C1.
What is the InChIKey of 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide?
The InChIKey is OAWXTCHNGXOLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c13-10-7-15(8-10)9-12(16)14-11-5-3-1-2-4-6-11/h10-11H,1-9,13H2,(H,14,16).
What are the key properties of 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide?
2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide has a molecular weight of 225.34 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide is sourced from PubChem (CID 63760720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).