N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine

C12H19N3O — CID 62285958

IUPACN-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine
SMILESCNCc1cccnc1N1CCOC(C)C1
InChIInChI=1S/C12H19N3O/c1-10-9-15(6-7-16-10)12-11(8-13-2)4-3-5-14-12/h3-5,10,13H,6-9H2,1-2H3
InChIKeyFKCHJYQLZZDCBX-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.03
Rot. Bonds3

About N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine

N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine (PubChem CID 62285958) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine
PubChem CID62285958
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine
SMILESCNCc1cccnc1N1CCOC(C)C1
InChIInChI=1S/C12H19N3O/c1-10-9-15(6-7-16-10)12-11(8-13-2)4-3-5-14-12/h3-5,10,13H,6-9H2,1-2H3
InChIKeyFKCHJYQLZZDCBX-UHFFFAOYSA-N
XLogP1.03
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine (CID 62285958) is N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine is CNCc1cccnc1N1CCOC(C)C1.
What is the InChIKey of N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine?
The InChIKey is FKCHJYQLZZDCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-10-9-15(6-7-16-10)12-11(8-13-2)4-3-5-14-12/h3-5,10,13H,6-9H2,1-2H3.
What are the key properties of N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine?
N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine has a molecular weight of 221.30 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 62285958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).