N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine

C10H16N2O — CID 3025105

IUPACN,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine
SMILESCN(C)CCOCc1cccnc1
InChIInChI=1S/C10H16N2O/c1-12(2)6-7-13-9-10-4-3-5-11-8-10/h3-5,8H,6-7,9H2,1-2H3
InChIKeyGNFRGVLOGOTYDN-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.16
Rot. Bonds5

About N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine

N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine (PubChem CID 3025105) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine
PubChem CID3025105
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine
SMILESCN(C)CCOCc1cccnc1
InChIInChI=1S/C10H16N2O/c1-12(2)6-7-13-9-10-4-3-5-11-8-10/h3-5,8H,6-7,9H2,1-2H3
InChIKeyGNFRGVLOGOTYDN-UHFFFAOYSA-N
XLogP1.16
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine?
The IUPAC name of N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine (CID 3025105) is N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine is CN(C)CCOCc1cccnc1.
What is the InChIKey of N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine?
The InChIKey is GNFRGVLOGOTYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-12(2)6-7-13-9-10-4-3-5-11-8-10/h3-5,8H,6-7,9H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine?
N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine has a molecular weight of 180.25 g/mol, XLogP of 1.16, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(pyridin-3-ylmethoxy)ethanamine is sourced from PubChem (CID 3025105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).