3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one

C11H20N2O — CID 126983370

IUPAC3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one
SMILESCC1(CCN2CC(N)C2=O)CCCC1
InChIInChI=1S/C11H20N2O/c1-11(4-2-3-5-11)6-7-13-8-9(12)10(13)14/h9H,2-8,12H2,1H3
InChIKeyXJFWQPLWHAWDCX-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.13
Rot. Bonds3

About 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one

3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one (PubChem CID 126983370) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one.

Molecular Properties

Compound Name3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one
PubChem CID126983370
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one
SMILESCC1(CCN2CC(N)C2=O)CCCC1
InChIInChI=1S/C11H20N2O/c1-11(4-2-3-5-11)6-7-13-8-9(12)10(13)14/h9H,2-8,12H2,1H3
InChIKeyXJFWQPLWHAWDCX-UHFFFAOYSA-N
XLogP1.13
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-1-methylazetidin-2-one
CID 70338843
4-[(3S)-3-amino-2-oxoazetidin-1-yl]-3-methylbutanoic acid
CID 67918002
3-amino-1-(2-methoxypropyl)azetidin-2-one
CID 102702135
methanamine;1-methyl-1-propylcyclohexane
CID 143166123
(3S)-3-amino-1-methylazetidin-2-one;hydron
CID 131858386
6-[(1-methylcyclopentyl)methyl]-4,6-diazaspiro[2.4]heptan-7-one
CID 83257758
1-[(1-methylcyclopentyl)methyl]azetidin-3-amine
CID 130577986
3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione
CID 64971281
3-amino-1-(2-ethylhexyl)azetidin-2-one
CID 107819375
3-amino-1-[(4-bromo-1-methylpyrazol-3-yl)methyl]azetidin-2-one
CID 131007203
1-[(1-methylcyclopentyl)methyl]-3-propylpiperazine-2,5-dione
CID 64971362
3-[(1-methylcyclopentyl)methyl]imidazolidin-4-one
CID 83256927

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one?
The IUPAC name of 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one (CID 126983370) is 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one.
What is the SMILES notation for 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one?
The canonical SMILES for 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one is CC1(CCN2CC(N)C2=O)CCCC1.
What is the InChIKey of 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one?
The InChIKey is XJFWQPLWHAWDCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-11(4-2-3-5-11)6-7-13-8-9(12)10(13)14/h9H,2-8,12H2,1H3.
What are the key properties of 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one?
3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one has a molecular weight of 196.29 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one is sourced from PubChem (CID 126983370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).