1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine

C13H21N3O — CID 62279244

IUPAC1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccnc(N2CC(C)OCC2C)c1
InChIInChI=1S/C13H21N3O/c1-10-9-17-11(2)8-16(10)13-6-12(7-14-3)4-5-15-13/h4-6,10-11,14H,7-9H2,1-3H3
InChIKeyPCRQNLSEBRRRRW-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.41
Rot. Bonds3

About 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine

1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine (PubChem CID 62279244) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine
PubChem CID62279244
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccnc(N2CC(C)OCC2C)c1
InChIInChI=1S/C13H21N3O/c1-10-9-17-11(2)8-16(10)13-6-12(7-14-3)4-5-15-13/h4-6,10-11,14H,7-9H2,1-3H3
InChIKeyPCRQNLSEBRRRRW-UHFFFAOYSA-N
XLogP1.41
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine (CID 62279244) is 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine is CNCc1ccnc(N2CC(C)OCC2C)c1.
What is the InChIKey of 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine?
The InChIKey is PCRQNLSEBRRRRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10-9-17-11(2)8-16(10)13-6-12(7-14-3)4-5-15-13/h4-6,10-11,14H,7-9H2,1-3H3.
What are the key properties of 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine?
1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine has a molecular weight of 235.33 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,5-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62279244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).