(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine

C23H28N4O — CID 125016910

IUPAC(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine
SMILESCc1ccccc1Cc1cccc([C@H]2CN(Cc3cnn(C)c3C)CCO2)n1
InChIInChI=1S/C23H28N4O/c1-17-7-4-5-8-19(17)13-21-9-6-10-22(25-21)23-16-27(11-12-28-23)15-20-14-24-26(3)18(20)2/h4-10,14,23H,11-13,15-16H2,1-3H3/t23-/m1/s1
InChIKeyXDQYCNBLKXXWPU-HSZRJFAPSA-N
MW376.50 g/mol
LogP3.60
Rot. Bonds5

About (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine

(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine (PubChem CID 125016910) has the molecular formula C23H28N4O and a molecular weight of 376.50 g/mol. Its IUPAC name is (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine.

Molecular Properties

Compound Name(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine
PubChem CID125016910
Molecular FormulaC23H28N4O
Molecular Weight376.50 g/mol
Exact Mass376.23
IUPAC Name(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine
SMILESCc1ccccc1Cc1cccc([C@H]2CN(Cc3cnn(C)c3C)CCO2)n1
InChIInChI=1S/C23H28N4O/c1-17-7-4-5-8-19(17)13-21-9-6-10-22(25-21)23-16-27(11-12-28-23)15-20-14-24-26(3)18(20)2/h4-10,14,23H,11-13,15-16H2,1-3H3/t23-/m1/s1
InChIKeyXDQYCNBLKXXWPU-HSZRJFAPSA-N
XLogP3.60
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine with MolForge

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Launch Full Analysis

Related Compounds

(2S)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-[(1-methylpyrazol-4-yl)methyl]morpholine
CID 124968837
N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine
CID 127249995
(2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine
CID 124963422
N-[6-[(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]morpholin-2-yl]-2-pyridinyl]-4,5-dimethyl-1,3-thiazol-2-amine
CID 124943201
(2S)-2-[6-[(2-chlorophenyl)methyl]-2-pyridinyl]-4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 124949958
2-[(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]morpholin-2-yl]-6-methylpyridin-4-amine
CID 124982771
(2S)-2-[6-methyl-4-[(2-methylphenyl)methyl]-2-pyridinyl]-4-[(1-methylpyrazol-4-yl)methyl]morpholine
CID 124949780
(2R)-2-(6-benzyl-2-pyridinyl)-4-[(1-ethylpyrazol-4-yl)methyl]morpholine
CID 124974858
(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-(4-methylpentyl)morpholine
CID 28872424
(2R)-4-(pyridin-3-ylmethyl)-2-[6-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]morpholine
CID 125008958
2-[4-[(1,5-dimethylpyrazol-4-yl)methyl]morpholin-2-yl]acetic acid
CID 79596226
2-isoquinolin-3-yl-4-[(2-methoxyphenyl)methyl]morpholine
CID 110218627

Frequently Asked Questions

What is the IUPAC name of (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine?
The IUPAC name of (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine (CID 125016910) is (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine.
What is the SMILES notation for (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine?
The canonical SMILES for (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine is Cc1ccccc1Cc1cccc([C@H]2CN(Cc3cnn(C)c3C)CCO2)n1.
What is the InChIKey of (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine?
The InChIKey is XDQYCNBLKXXWPU-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H28N4O/c1-17-7-4-5-8-19(17)13-21-9-6-10-22(25-21)23-16-27(11-12-28-23)15-20-14-24-26(3)18(20)2/h4-10,14,23H,11-13,15-16H2,1-3H3/t23-/m1/s1.
What are the key properties of (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine?
(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine has a molecular weight of 376.50 g/mol, XLogP of 3.60, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine is sourced from PubChem (CID 125016910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).