1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine

C16H27N3O — CID 62289026

IUPAC1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
SMILESCCC1COC(C)CN1c1nc(C)cc(C)c1CNC
InChIInChI=1S/C16H27N3O/c1-6-14-10-20-13(4)9-19(14)16-15(8-17-5)11(2)7-12(3)18-16/h7,13-14,17H,6,8-10H2,1-5H3
InChIKeyUFQMGZWEBYOWKB-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.42
Rot. Bonds4

About 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine

1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine (PubChem CID 62289026) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
PubChem CID62289026
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
SMILESCCC1COC(C)CN1c1nc(C)cc(C)c1CNC
InChIInChI=1S/C16H27N3O/c1-6-14-10-20-13(4)9-19(14)16-15(8-17-5)11(2)7-12(3)18-16/h7,13-14,17H,6,8-10H2,1-5H3
InChIKeyUFQMGZWEBYOWKB-UHFFFAOYSA-N
XLogP2.42
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine (CID 62289026) is 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine is CCC1COC(C)CN1c1nc(C)cc(C)c1CNC.
What is the InChIKey of 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine?
The InChIKey is UFQMGZWEBYOWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-6-14-10-20-13(4)9-19(14)16-15(8-17-5)11(2)7-12(3)18-16/h7,13-14,17H,6,8-10H2,1-5H3.
What are the key properties of 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine?
1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine has a molecular weight of 277.41 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62289026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).