[1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol

C13H24N2O2 — CID 82856515

IUPAC[1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol
SMILESOCC1(NCC2CCCO2)CCN2CCCC21
InChIInChI=1S/C13H24N2O2/c16-10-13(14-9-11-3-2-8-17-11)5-7-15-6-1-4-12(13)15/h11-12,14,16H,1-10H2
InChIKeyFXWFJZMCXDOWFK-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.35
Rot. Bonds4

About [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol

[1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol (PubChem CID 82856515) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol.

Molecular Properties

Compound Name[1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol
PubChem CID82856515
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name[1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol
SMILESOCC1(NCC2CCCO2)CCN2CCCC21
InChIInChI=1S/C13H24N2O2/c16-10-13(14-9-11-3-2-8-17-11)5-7-15-6-1-4-12(13)15/h11-12,14,16H,1-10H2
InChIKeyFXWFJZMCXDOWFK-UHFFFAOYSA-N
XLogP0.35
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(benzylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol
CID 82855751
1-cyclopropyl-3-(oxolan-2-ylmethylamino)pyrrolidine-3-carboxylic acid
CID 55141024
[4-(oxolan-2-ylmethylamino)-1-propan-2-ylpiperidin-4-yl]methanol
CID 61047764
[2-(oxolan-2-ylmethylamino)-2-adamantyl]methanol
CID 64758498
(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol
CID 101202509
(1S,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol
CID 163074803
[1-benzyl-3-(oxolan-2-ylmethylamino)pyrrolidin-3-yl]methanol
CID 61049771
1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
CID 65376736
2,4-dimethyl-1-(oxolan-2-ylmethylamino)cyclohexane-1-carboxylic acid
CID 64756379
3-(oxolan-2-ylmethylamino)azetidine-3-carboxylic acid
CID 132594065
methyl 1-(oxolan-2-ylmethylamino)cyclobutane-1-carboxylate
CID 62389460
[(2S)-oxolan-2-yl]methylcarbamic acid
CID 69040354

Frequently Asked Questions

What is the IUPAC name of [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol?
The IUPAC name of [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol (CID 82856515) is [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol.
What is the SMILES notation for [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol?
The canonical SMILES for [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol is OCC1(NCC2CCCO2)CCN2CCCC21.
What is the InChIKey of [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol?
The InChIKey is FXWFJZMCXDOWFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c16-10-13(14-9-11-3-2-8-17-11)5-7-15-6-1-4-12(13)15/h11-12,14,16H,1-10H2.
What are the key properties of [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol?
[1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol has a molecular weight of 240.35 g/mol, XLogP of 0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxolan-2-ylmethylamino)-2,3,5,6,7,8-hexahydropyrrolizin-1-yl]methanol is sourced from PubChem (CID 82856515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).