1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine

C14H22ClN3O — CID 62293419

IUPAC1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1nc(N2CC(C)OC(C)(C)C2)ccc1Cl
InChIInChI=1S/C14H22ClN3O/c1-10-8-18(9-14(2,3)19-10)13-6-5-11(15)12(17-13)7-16-4/h5-6,10,16H,7-9H2,1-4H3
InChIKeyGGUOMWCQEDAUTC-UHFFFAOYSA-N
MW283.80 g/mol
LogP2.46
Rot. Bonds3

About 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine

1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine (PubChem CID 62293419) has the molecular formula C14H22ClN3O and a molecular weight of 283.80 g/mol. Its IUPAC name is 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine
PubChem CID62293419
Molecular FormulaC14H22ClN3O
Molecular Weight283.80 g/mol
Exact Mass283.15
IUPAC Name1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1nc(N2CC(C)OC(C)(C)C2)ccc1Cl
InChIInChI=1S/C14H22ClN3O/c1-10-8-18(9-14(2,3)19-10)13-6-5-11(15)12(17-13)7-16-4/h5-6,10,16H,7-9H2,1-4H3
InChIKeyGGUOMWCQEDAUTC-UHFFFAOYSA-N
XLogP2.46
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine (CID 62293419) is 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine is CNCc1nc(N2CC(C)OC(C)(C)C2)ccc1Cl.
What is the InChIKey of 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine?
The InChIKey is GGUOMWCQEDAUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN3O/c1-10-8-18(9-14(2,3)19-10)13-6-5-11(15)12(17-13)7-16-4/h5-6,10,16H,7-9H2,1-4H3.
What are the key properties of 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine?
1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine has a molecular weight of 283.80 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-chloro-6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62293419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).