4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine

C11H15ClN2O — CID 166928502

IUPAC4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine
SMILESCc1cc(Cl)cc(N2CCOCC2C)n1
InChIInChI=1S/C11H15ClN2O/c1-8-5-10(12)6-11(13-8)14-3-4-15-7-9(14)2/h5-6,9H,3-4,7H2,1-2H3
InChIKeyUBBMRZFIHDPLPV-UHFFFAOYSA-N
MW226.71 g/mol
LogP2.27
Rot. Bonds1

About 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine

4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine (PubChem CID 166928502) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine.

Molecular Properties

Compound Name4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine
PubChem CID166928502
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC Name4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine
SMILESCc1cc(Cl)cc(N2CCOCC2C)n1
InChIInChI=1S/C11H15ClN2O/c1-8-5-10(12)6-11(13-8)14-3-4-15-7-9(14)2/h5-6,9H,3-4,7H2,1-2H3
InChIKeyUBBMRZFIHDPLPV-UHFFFAOYSA-N
XLogP2.27
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine?
The IUPAC name of 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine (CID 166928502) is 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine.
What is the SMILES notation for 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine?
The canonical SMILES for 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine is Cc1cc(Cl)cc(N2CCOCC2C)n1.
What is the InChIKey of 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine?
The InChIKey is UBBMRZFIHDPLPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c1-8-5-10(12)6-11(13-8)14-3-4-15-7-9(14)2/h5-6,9H,3-4,7H2,1-2H3.
What are the key properties of 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine?
4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine has a molecular weight of 226.71 g/mol, XLogP of 2.27, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chloro-6-methyl-2-pyridinyl)-3-methylmorpholine is sourced from PubChem (CID 166928502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).