1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol

C11H22N2O — CID 67772010

IUPAC1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol
SMILESCNC(CN1CC(O)C1)C1CCCC1
InChIInChI=1S/C11H22N2O/c1-12-11(9-4-2-3-5-9)8-13-6-10(14)7-13/h9-12,14H,2-8H2,1H3
InChIKeyYOQGMJABOOQSTR-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.44
Rot. Bonds4

About 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol

1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol (PubChem CID 67772010) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol.

Molecular Properties

Compound Name1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol
PubChem CID67772010
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol
SMILESCNC(CN1CC(O)C1)C1CCCC1
InChIInChI=1S/C11H22N2O/c1-12-11(9-4-2-3-5-9)8-13-6-10(14)7-13/h9-12,14H,2-8H2,1H3
InChIKeyYOQGMJABOOQSTR-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2S)-2-cyclohexyl-2-(methylamino)ethyl]azetidin-3-ol
CID 67773410
1-cyclopentyl-2-(3,5-dimethylpiperidin-1-yl)-N-methylethanamine
CID 104744232
1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
CID 113448343
1-[2-cyclohexyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
CID 104746881
1-cyclopentyl-N-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanamine
CID 104746172
1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine
CID 104746257
1-cyclohexyl-N-methyl-2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)ethanamine
CID 104746658
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-1-cyclopentyl-N-methylethanamine
CID 104746104
1-cyclopentyl-N-methyl-2-(2-methylmorpholin-4-yl)ethanamine
CID 104744362
1-cyclohexyl-N-methyl-2-(2-methylmorpholin-4-yl)ethanamine
CID 113447979
1-cyclohexyl-2-(3-ethyl-4-methylpiperazin-1-yl)-N-methylethanamine
CID 104746281
1-cyclopentyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-N-methylethanamine
CID 104745994

Frequently Asked Questions

What is the IUPAC name of 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol?
The IUPAC name of 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol (CID 67772010) is 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol.
What is the SMILES notation for 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol?
The canonical SMILES for 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol is CNC(CN1CC(O)C1)C1CCCC1.
What is the InChIKey of 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol?
The InChIKey is YOQGMJABOOQSTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-12-11(9-4-2-3-5-9)8-13-6-10(14)7-13/h9-12,14H,2-8H2,1H3.
What are the key properties of 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol?
1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol has a molecular weight of 198.31 g/mol, XLogP of 0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-cyclopentyl-2-(methylamino)ethyl]azetidin-3-ol is sourced from PubChem (CID 67772010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).