N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine

C13H20N2O — CID 7537524

IUPACN-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine
SMILESCNCc1cccc(CN2CCOCC2)c1
InChIInChI=1S/C13H20N2O/c1-14-10-12-3-2-4-13(9-12)11-15-5-7-16-8-6-15/h2-4,9,14H,5-8,10-11H2,1H3
InChIKeyJZMYRFZAMCXUIF-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.24
Rot. Bonds4

About N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine

N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine (PubChem CID 7537524) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine
PubChem CID7537524
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine
SMILESCNCc1cccc(CN2CCOCC2)c1
InChIInChI=1S/C13H20N2O/c1-14-10-12-3-2-4-13(9-12)11-15-5-7-16-8-6-15/h2-4,9,14H,5-8,10-11H2,1H3
InChIKeyJZMYRFZAMCXUIF-UHFFFAOYSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine?
The IUPAC name of N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine (CID 7537524) is N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine?
The canonical SMILES for N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine is CNCc1cccc(CN2CCOCC2)c1.
What is the InChIKey of N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine?
The InChIKey is JZMYRFZAMCXUIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-14-10-12-3-2-4-13(9-12)11-15-5-7-16-8-6-15/h2-4,9,14H,5-8,10-11H2,1H3.
What are the key properties of N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine?
N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine has a molecular weight of 220.32 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-(morpholin-4-ylmethyl)phenyl]methanamine is sourced from PubChem (CID 7537524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).