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

C10H20N2O — CID 167179789

IUPAC[8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol
SMILESCNCC12CCCN1C(CO)CC2
InChIInChI=1S/C10H20N2O/c1-11-8-10-4-2-6-12(10)9(7-13)3-5-10/h9,11,13H,2-8H2,1H3
InChIKeyUAPIBYQUOAARBJ-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.20
Rot. Bonds3

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

[8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol (PubChem CID 167179789) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol.

Molecular Properties

Compound Name[8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol
PubChem CID167179789
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name[8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol
SMILESCNCC12CCCN1C(CO)CC2
InChIInChI=1S/C10H20N2O/c1-11-8-10-4-2-6-12(10)9(7-13)3-5-10/h9,11,13H,2-8H2,1H3
InChIKeyUAPIBYQUOAARBJ-UHFFFAOYSA-N
XLogP0.20
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol?
The IUPAC name of [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol (CID 167179789) is [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol.
What is the SMILES notation for [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol?
The canonical SMILES for [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol is CNCC12CCCN1C(CO)CC2.
What is the InChIKey of [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol?
The InChIKey is UAPIBYQUOAARBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-11-8-10-4-2-6-12(10)9(7-13)3-5-10/h9,11,13H,2-8H2,1H3.
What are the key properties of [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol?
[8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol has a molecular weight of 184.28 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol is sourced from PubChem (CID 167179789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).