N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine

C13H21N3O — CID 66426851

IUPACN-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine
SMILESCN(CCC1CNCCO1)Cc1ccccn1
InChIInChI=1S/C13H21N3O/c1-16(11-12-4-2-3-6-15-12)8-5-13-10-14-7-9-17-13/h2-4,6,13-14H,5,7-11H2,1H3
InChIKeyIPGPOWGZTMXTRJ-UHFFFAOYSA-N
MW235.33 g/mol
LogP0.89
Rot. Bonds5

About N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine

N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine (PubChem CID 66426851) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine
PubChem CID66426851
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine
SMILESCN(CCC1CNCCO1)Cc1ccccn1
InChIInChI=1S/C13H21N3O/c1-16(11-12-4-2-3-6-15-12)8-5-13-10-14-7-9-17-13/h2-4,6,13-14H,5,7-11H2,1H3
InChIKeyIPGPOWGZTMXTRJ-UHFFFAOYSA-N
XLogP0.89
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine?
The IUPAC name of N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine (CID 66426851) is N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine?
The canonical SMILES for N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine is CN(CCC1CNCCO1)Cc1ccccn1.
What is the InChIKey of N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine?
The InChIKey is IPGPOWGZTMXTRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-16(11-12-4-2-3-6-15-12)8-5-13-10-14-7-9-17-13/h2-4,6,13-14H,5,7-11H2,1H3.
What are the key properties of N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine?
N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine has a molecular weight of 235.33 g/mol, XLogP of 0.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-morpholin-2-yl-N-(pyridin-2-ylmethyl)ethanamine is sourced from PubChem (CID 66426851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).