2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine

C9H20N2O — CID 62371781

IUPAC2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
SMILESCOCCN(C)CC1CCNC1
InChIInChI=1S/C9H20N2O/c1-11(5-6-12-2)8-9-3-4-10-7-9/h9-10H,3-8H2,1-2H3
InChIKeyJKQCQKAXLIEUNG-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.17
Rot. Bonds5

About 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine

2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine (PubChem CID 62371781) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
PubChem CID62371781
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
SMILESCOCCN(C)CC1CCNC1
InChIInChI=1S/C9H20N2O/c1-11(5-6-12-2)8-9-3-4-10-7-9/h9-10H,3-8H2,1-2H3
InChIKeyJKQCQKAXLIEUNG-UHFFFAOYSA-N
XLogP0.17
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-propan-2-yloxy-N-(pyrrolidin-3-ylmethyl)ethanamine
CID 81055965
2-(2-methoxyethoxy)-N-methyl-N-(piperidin-3-ylmethyl)ethanamine
CID 106636684
N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine
CID 54596082
3,3-difluoro-N-methyl-N-(pyrrolidin-3-ylmethyl)butan-1-amine
CID 84674397
1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
CID 62860068
N,4-dimethyl-N-(pyrrolidin-3-ylmethyl)pentan-1-amine
CID 115209057
2-(azetidin-3-yl)-N-(2-methoxyethyl)-N-methylethanamine
CID 116679616
N,N-dimethyl-1-pyrrolidin-3-ylmethanamine;dihydrochloride
CID 23145859
N-methyl-2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)ethanamine
CID 106636675
(Z)-N-methyl-N-(pyrrolidin-3-ylmethyl)but-2-en-1-amine
CID 143248520
N,N-bis(2-methoxyethyl)piperidin-4-amine
CID 61418821
N-(2-methoxyethyl)-N-propan-2-yl-2-pyrrolidin-3-ylacetamide
CID 82949070

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
The IUPAC name of 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine (CID 62371781) is 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine.
What is the SMILES notation for 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
The canonical SMILES for 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine is COCCN(C)CC1CCNC1.
What is the InChIKey of 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
The InChIKey is JKQCQKAXLIEUNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-11(5-6-12-2)8-9-3-4-10-7-9/h9-10H,3-8H2,1-2H3.
What are the key properties of 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine has a molecular weight of 172.27 g/mol, XLogP of 0.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine is sourced from PubChem (CID 62371781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).