2-(1-methylpyrrolidin-3-yl)oxyethanamine

C7H16N2O — CID 66563884

IUPAC2-(1-methylpyrrolidin-3-yl)oxyethanamine
SMILESCN1CCC(OCCN)C1
InChIInChI=1S/C7H16N2O/c1-9-4-2-7(6-9)10-5-3-8/h7H,2-6,8H2,1H3
InChIKeyDVDKYDHITCFEBU-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.33
Rot. Bonds3

About 2-(1-methylpyrrolidin-3-yl)oxyethanamine

2-(1-methylpyrrolidin-3-yl)oxyethanamine (PubChem CID 66563884) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 2-(1-methylpyrrolidin-3-yl)oxyethanamine.

Molecular Properties

Compound Name2-(1-methylpyrrolidin-3-yl)oxyethanamine
PubChem CID66563884
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name2-(1-methylpyrrolidin-3-yl)oxyethanamine
SMILESCN1CCC(OCCN)C1
InChIInChI=1S/C7H16N2O/c1-9-4-2-7(6-9)10-5-3-8/h7H,2-6,8H2,1H3
InChIKeyDVDKYDHITCFEBU-UHFFFAOYSA-N
XLogP-0.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrrolidin-3-yl)oxyethanamine?
The IUPAC name of 2-(1-methylpyrrolidin-3-yl)oxyethanamine (CID 66563884) is 2-(1-methylpyrrolidin-3-yl)oxyethanamine.
What is the SMILES notation for 2-(1-methylpyrrolidin-3-yl)oxyethanamine?
The canonical SMILES for 2-(1-methylpyrrolidin-3-yl)oxyethanamine is CN1CCC(OCCN)C1.
What is the InChIKey of 2-(1-methylpyrrolidin-3-yl)oxyethanamine?
The InChIKey is DVDKYDHITCFEBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-9-4-2-7(6-9)10-5-3-8/h7H,2-6,8H2,1H3.
What are the key properties of 2-(1-methylpyrrolidin-3-yl)oxyethanamine?
2-(1-methylpyrrolidin-3-yl)oxyethanamine has a molecular weight of 144.22 g/mol, XLogP of -0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrrolidin-3-yl)oxyethanamine is sourced from PubChem (CID 66563884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).