8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane

C13H24N2 — CID 83909259

IUPAC8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane
SMILESCN1C2CCC1CC(CC1CCCN1)C2
InChIInChI=1S/C13H24N2/c1-15-12-4-5-13(15)9-10(8-12)7-11-3-2-6-14-11/h10-14H,2-9H2,1H3
InChIKeyQCQNJEWBPAQSQX-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.00
Rot. Bonds2

About 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane

8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane (PubChem CID 83909259) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane
PubChem CID83909259
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane
SMILESCN1C2CCC1CC(CC1CCCN1)C2
InChIInChI=1S/C13H24N2/c1-15-12-4-5-13(15)9-10(8-12)7-11-3-2-6-14-11/h10-14H,2-9H2,1H3
InChIKeyQCQNJEWBPAQSQX-UHFFFAOYSA-N
XLogP2.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclobutylmethyl)pyrrolidine
CID 77248341
2-[(3,5-dimethylcyclohexyl)methyl]piperidine
CID 64731136
2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106606511
8-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine
CID 106621974
2-(thietan-3-ylmethyl)pyrrolidine
CID 83905279
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrrolidine-2-carboxamide
CID 54898994
(2R)-2-(cyclobutylmethyl)piperidine
CID 99737651
2-(cycloheptylmethyl)piperidine
CID 79006754
(2S)-2-(cyclohexylmethyl)piperidine
CID 51377530
1-methyl-6-(piperidin-2-ylmethyl)-1-azaspiro[3.3]heptane
CID 135230048
2-(thiolan-3-ylmethyl)pyrrolidine
CID 82653355
(2S)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]piperidine-2-carboxamide
CID 104913494

Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane?
The IUPAC name of 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane (CID 83909259) is 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane is CN1C2CCC1CC(CC1CCCN1)C2.
What is the InChIKey of 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane?
The InChIKey is QCQNJEWBPAQSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-15-12-4-5-13(15)9-10(8-12)7-11-3-2-6-14-11/h10-14H,2-9H2,1H3.
What are the key properties of 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane?
8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane has a molecular weight of 208.35 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-(pyrrolidin-2-ylmethyl)-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 83909259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).