(2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine

C21H22N4O — CID 124963422

IUPAC(2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine
SMILESCc1ccccc1Cc1cccc([C@H]2CN(c3ncccn3)CCO2)n1
InChIInChI=1S/C21H22N4O/c1-16-6-2-3-7-17(16)14-18-8-4-9-19(24-18)20-15-25(12-13-26-20)21-22-10-5-11-23-21/h2-11,20H,12-15H2,1H3/t20-/m1/s1
InChIKeyHQDYZYMEAIZMTJ-HXUWFJFHSA-N
MW346.43 g/mol
LogP3.35
Rot. Bonds4

About (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine

(2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine (PubChem CID 124963422) has the molecular formula C21H22N4O and a molecular weight of 346.43 g/mol. Its IUPAC name is (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine.

Molecular Properties

Compound Name(2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine
PubChem CID124963422
Molecular FormulaC21H22N4O
Molecular Weight346.43 g/mol
Exact Mass346.18
IUPAC Name(2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine
SMILESCc1ccccc1Cc1cccc([C@H]2CN(c3ncccn3)CCO2)n1
InChIInChI=1S/C21H22N4O/c1-16-6-2-3-7-17(16)14-18-8-4-9-19(24-18)20-15-25(12-13-26-20)21-22-10-5-11-23-21/h2-11,20H,12-15H2,1H3/t20-/m1/s1
InChIKeyHQDYZYMEAIZMTJ-HXUWFJFHSA-N
XLogP3.35
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-[(1-methylpyrazol-4-yl)methyl]morpholine
CID 124968837
(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine
CID 125016910
N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine
CID 127249995
(2R)-2-[5-[(2-fluorophenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine
CID 124943851
2-[(2-methylphenyl)methyl]-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridine
CID 95809282
(2S)-2-[6-[(2-chlorophenyl)methyl]-2-pyridinyl]-4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 124949958
(2-methyl-1,3-oxazol-4-yl)-[4-[6-[(2-methylphenyl)methyl]-2-pyridinyl]piperidin-1-yl]methanone
CID 95810801
(2R)-4-(pyridin-3-ylmethyl)-2-[6-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]morpholine
CID 125008958
[(2S)-2-[6-[(2-chlorophenyl)methyl]-2-pyridinyl]morpholin-4-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 125007104
2-methyl-1-[2-[6-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]morpholin-4-yl]propan-1-one
CID 127249939
N,N-dimethyl-3-[6-(4-pyrimidin-2-ylmorpholin-2-yl)pyrazin-2-yl]propanamide
CID 110268083
2-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]-6-[(2-methylphenyl)methyl]pyridine
CID 95810677

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine?
The IUPAC name of (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine (CID 124963422) is (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine.
What is the SMILES notation for (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine?
The canonical SMILES for (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine is Cc1ccccc1Cc1cccc([C@H]2CN(c3ncccn3)CCO2)n1.
What is the InChIKey of (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine?
The InChIKey is HQDYZYMEAIZMTJ-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H22N4O/c1-16-6-2-3-7-17(16)14-18-8-4-9-19(24-18)20-15-25(12-13-26-20)21-22-10-5-11-23-21/h2-11,20H,12-15H2,1H3/t20-/m1/s1.
What are the key properties of (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine?
(2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine has a molecular weight of 346.43 g/mol, XLogP of 3.35, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine is sourced from PubChem (CID 124963422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).