(2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine

C16H20N2O — CID 94062962

IUPAC(2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine
SMILESC[C@@H]1CN(Cc2cccc3cccnc23)[C@H](C)CO1
InChIInChI=1S/C16H20N2O/c1-12-11-19-13(2)9-18(12)10-15-6-3-5-14-7-4-8-17-16(14)15/h3-8,12-13H,9-11H2,1-2H3/t12-,13-/m1/s1
InChIKeyKJJQPHAQWNARPC-CHWSQXEVSA-N
MW256.35 g/mol
LogP2.84
Rot. Bonds2

About (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine

(2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine (PubChem CID 94062962) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine.

Molecular Properties

Compound Name(2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine
PubChem CID94062962
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name(2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine
SMILESC[C@@H]1CN(Cc2cccc3cccnc23)[C@H](C)CO1
InChIInChI=1S/C16H20N2O/c1-12-11-19-13(2)9-18(12)10-15-6-3-5-14-7-4-8-17-16(14)15/h3-8,12-13H,9-11H2,1-2H3/t12-,13-/m1/s1
InChIKeyKJJQPHAQWNARPC-CHWSQXEVSA-N
XLogP2.84
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine?
The IUPAC name of (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine (CID 94062962) is (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine.
What is the SMILES notation for (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine?
The canonical SMILES for (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine is C[C@@H]1CN(Cc2cccc3cccnc23)[C@H](C)CO1.
What is the InChIKey of (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine?
The InChIKey is KJJQPHAQWNARPC-CHWSQXEVSA-N. The full InChI is InChI=1S/C16H20N2O/c1-12-11-19-13(2)9-18(12)10-15-6-3-5-14-7-4-8-17-16(14)15/h3-8,12-13H,9-11H2,1-2H3/t12-,13-/m1/s1.
What are the key properties of (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine?
(2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine has a molecular weight of 256.35 g/mol, XLogP of 2.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-2,5-dimethyl-4-(quinolin-8-ylmethyl)morpholine is sourced from PubChem (CID 94062962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).