N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine

C8H18N2O — CID 13049041

IUPACN,N-dimethyl-2-pyrrolidin-3-yloxyethanamine
SMILESCN(C)CCOC1CCNC1
InChIInChI=1S/C8H18N2O/c1-10(2)5-6-11-8-3-4-9-7-8/h8-9H,3-7H2,1-2H3
InChIKeyJGUJECMONXPQGD-UHFFFAOYSA-N
MW158.25 g/mol
LogP-0.07
Rot. Bonds4

About N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine

N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine (PubChem CID 13049041) has the molecular formula C8H18N2O and a molecular weight of 158.25 g/mol. Its IUPAC name is N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-pyrrolidin-3-yloxyethanamine
PubChem CID13049041
Molecular FormulaC8H18N2O
Molecular Weight158.25 g/mol
Exact Mass158.14
IUPAC NameN,N-dimethyl-2-pyrrolidin-3-yloxyethanamine
SMILESCN(C)CCOC1CCNC1
InChIInChI=1S/C8H18N2O/c1-10(2)5-6-11-8-3-4-9-7-8/h8-9H,3-7H2,1-2H3
InChIKeyJGUJECMONXPQGD-UHFFFAOYSA-N
XLogP-0.07
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.25
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine?
The IUPAC name of N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine (CID 13049041) is N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine.
What is the SMILES notation for N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine?
The canonical SMILES for N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine is CN(C)CCOC1CCNC1.
What is the InChIKey of N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine?
The InChIKey is JGUJECMONXPQGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-10(2)5-6-11-8-3-4-9-7-8/h8-9H,3-7H2,1-2H3.
What are the key properties of N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine?
N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine has a molecular weight of 158.25 g/mol, XLogP of -0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-pyrrolidin-3-yloxyethanamine is sourced from PubChem (CID 13049041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).