[1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol

C9H18N2O — CID 102789766

IUPAC[1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol
SMILESCC1CCN(C2CNC2)C1CO
InChIInChI=1S/C9H18N2O/c1-7-2-3-11(9(7)6-12)8-4-10-5-8/h7-10,12H,2-6H2,1H3
InChIKeyDYVSYDABWCLHHK-UHFFFAOYSA-N
MW170.26 g/mol
LogP-0.34
Rot. Bonds2

About [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol

[1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol (PubChem CID 102789766) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol
PubChem CID102789766
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name[1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol
SMILESCC1CCN(C2CNC2)C1CO
InChIInChI=1S/C9H18N2O/c1-7-2-3-11(9(7)6-12)8-4-10-5-8/h7-10,12H,2-6H2,1H3
InChIKeyDYVSYDABWCLHHK-UHFFFAOYSA-N
XLogP-0.34
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1-cyclopentyl-3-methylpyrrolidin-2-yl)methanol
CID 102788516
[1-(azetidin-3-yl)-3-methylpiperidin-2-yl]methanamine
CID 130622217
2-(azetidin-3-yl)-1-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]ethanone
CID 102780602
[3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol
CID 102787849
[1-[2-(aminomethyl)cycloheptyl]-3-methylpyrrolidin-2-yl]methanol
CID 102778150
2-(hydroxymethyl)-3-methylpyrrolidine-1-carbonitrile
CID 102780736
[3-methyl-1-(2-sulfanylethyl)pyrrolidin-2-yl]methanol
CID 102789795
1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazin-4-ylmethanol
CID 59215878
[1-(2-fluoroethyl)-3-methylpyrrolidin-2-yl]methanol
CID 102787851
3-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 103313938
methyl 2-(hydroxymethyl)-3-methylpyrrolidine-1-carboxylate
CID 102738593
[3-methyl-1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]methanol
CID 102787854

Frequently Asked Questions

What is the IUPAC name of [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol?
The IUPAC name of [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol (CID 102789766) is [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol is CC1CCN(C2CNC2)C1CO.
What is the InChIKey of [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol?
The InChIKey is DYVSYDABWCLHHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7-2-3-11(9(7)6-12)8-4-10-5-8/h7-10,12H,2-6H2,1H3.
What are the key properties of [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol?
[1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol has a molecular weight of 170.26 g/mol, XLogP of -0.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(azetidin-3-yl)-3-methylpyrrolidin-2-yl]methanol is sourced from PubChem (CID 102789766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).