1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone

C11H20N2O2 — CID 103558366

IUPAC1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone
SMILESCOC1(CC(=O)N2CC(C)(N)C2)CCC1
InChIInChI=1S/C11H20N2O2/c1-10(12)7-13(8-10)9(14)6-11(15-2)4-3-5-11/h3-8,12H2,1-2H3
InChIKeyKYRUZDBRHWCSDY-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.51
Rot. Bonds3

About 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone

1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone (PubChem CID 103558366) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone.

Molecular Properties

Compound Name1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone
PubChem CID103558366
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone
SMILESCOC1(CC(=O)N2CC(C)(N)C2)CCC1
InChIInChI=1S/C11H20N2O2/c1-10(12)7-13(8-10)9(14)6-11(15-2)4-3-5-11/h3-8,12H2,1-2H3
InChIKeyKYRUZDBRHWCSDY-UHFFFAOYSA-N
XLogP0.51
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethyl-3-hydroxyazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone
CID 103557185
1-(3-aminopyrrolidin-1-yl)-2-(1-methoxycyclobutyl)ethanone
CID 103557253
1-[2-(1-methoxycyclobutyl)acetyl]azetidine-3-carboxylic acid
CID 103555656
N'-hydroxy-1-[2-(1-methoxycyclobutyl)acetyl]piperidine-4-carboximidamide
CID 103557944
1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-(1-methoxycyclobutyl)ethanone
CID 103557199
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-(1-methoxycyclobutyl)ethanone
CID 103520062
1-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-2-(1-methoxycyclobutyl)ethanone
CID 103557359
1-[4-(cyclopropylmethylamino)piperidin-1-yl]-2-(1-methoxycyclobutyl)ethanone
CID 103557372
(4R)-4-[1-[2-(1-methoxycyclobutyl)acetyl]piperidin-4-yl]-3,3-dimethylazetidin-2-one
CID 129345065
1-[2-(1-methoxycyclobutyl)acetyl]piperidine-3-sulfonamide
CID 103522077
2-(1-methoxycyclobutyl)acetohydrazide
CID 103555801
2-[(2R)-4-[2-(1-methoxycyclobutyl)acetyl]morpholin-2-yl]acetic acid
CID 129414298

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone?
The IUPAC name of 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone (CID 103558366) is 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone.
What is the SMILES notation for 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone?
The canonical SMILES for 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone is COC1(CC(=O)N2CC(C)(N)C2)CCC1.
What is the InChIKey of 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone?
The InChIKey is KYRUZDBRHWCSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-10(12)7-13(8-10)9(14)6-11(15-2)4-3-5-11/h3-8,12H2,1-2H3.
What are the key properties of 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone?
1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone has a molecular weight of 212.29 g/mol, XLogP of 0.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-3-methylazetidin-1-yl)-2-(1-methoxycyclobutyl)ethanone is sourced from PubChem (CID 103558366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).