2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol

C15H29N3O — CID 106606511

IUPAC2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESCN1C2CCC1CC(N(CCO)CC1CCCN1)C2
InChIInChI=1S/C15H29N3O/c1-17-13-4-5-14(17)10-15(9-13)18(7-8-19)11-12-3-2-6-16-12/h12-16,19H,2-11H2,1H3
InChIKeyMALYHPHWNFYPFQ-UHFFFAOYSA-N
MW267.42 g/mol
LogP0.66
Rot. Bonds5

About 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol

2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol (PubChem CID 106606511) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
PubChem CID106606511
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESCN1C2CCC1CC(N(CCO)CC1CCCN1)C2
InChIInChI=1S/C15H29N3O/c1-17-13-4-5-14(17)10-15(9-13)18(7-8-19)11-12-3-2-6-16-12/h12-16,19H,2-11H2,1H3
InChIKeyMALYHPHWNFYPFQ-UHFFFAOYSA-N
XLogP0.66
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol with MolForge

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Related Compounds

2-[(1-methylpyrrolidin-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106606838
2-[(1-propylpiperidin-4-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106607106
8-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine
CID 106621974
2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106606785
3-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-1-methylpyrrolidin-2-one
CID 106617859
8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane
CID 83909259
N-butyl-2,6-dimethyl-N-(pyrrolidin-2-ylmethyl)oxan-4-amine
CID 106604803
2-[1-cyclopropylethyl(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106606811
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 106606366
N-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexanamine
CID 106603994
N-(2-fluoroethyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
CID 106599783
2-[2-(dimethylamino)ethyl-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106618094

Frequently Asked Questions

What is the IUPAC name of 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The IUPAC name of 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol (CID 106606511) is 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol is CN1C2CCC1CC(N(CCO)CC1CCCN1)C2.
What is the InChIKey of 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The InChIKey is MALYHPHWNFYPFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-17-13-4-5-14(17)10-15(9-13)18(7-8-19)11-12-3-2-6-16-12/h12-16,19H,2-11H2,1H3.
What are the key properties of 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol has a molecular weight of 267.42 g/mol, XLogP of 0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol is sourced from PubChem (CID 106606511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).