4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine

C22H24N4O — CID 56872749

IUPAC4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine
SMILESCc1ccc(-c2ccnc(-c3ccccc3CN3CCOCC3)n2)c(C)n1
InChIInChI=1S/C22H24N4O/c1-16-7-8-19(17(2)24-16)21-9-10-23-22(25-21)20-6-4-3-5-18(20)15-26-11-13-27-14-12-26/h3-10H,11-15H2,1-2H3
InChIKeyZBWIMDUDWWGQTA-UHFFFAOYSA-N
MW360.46 g/mol
LogP3.65
Rot. Bonds4

About 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine

4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine (PubChem CID 56872749) has the molecular formula C22H24N4O and a molecular weight of 360.46 g/mol. Its IUPAC name is 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine.

Molecular Properties

Compound Name4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine
PubChem CID56872749
Molecular FormulaC22H24N4O
Molecular Weight360.46 g/mol
Exact Mass360.20
IUPAC Name4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine
SMILESCc1ccc(-c2ccnc(-c3ccccc3CN3CCOCC3)n2)c(C)n1
InChIInChI=1S/C22H24N4O/c1-16-7-8-19(17(2)24-16)21-9-10-23-22(25-21)20-6-4-3-5-18(20)15-26-11-13-27-14-12-26/h3-10H,11-15H2,1-2H3
InChIKeyZBWIMDUDWWGQTA-UHFFFAOYSA-N
XLogP3.65
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide
CID 50967003
4-[2-(morpholin-4-ylmethyl)phenyl]-N-phenyl-1,3,5-triazin-2-amine
CID 141438948
4-[[2-(3-methoxy-2-pyridinyl)phenyl]methyl]morpholine
CID 74250444
ethane;4-[(2-methylphenyl)methyl]morpholine
CID 142083627
N-ethyl-6-[2-(morpholin-4-ylmethyl)phenyl]pyridazin-3-amine
CID 72889282
4-[[2-(8-methoxyquinolin-5-yl)phenyl]methyl]morpholine
CID 72915247
4-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]pyrimidin-2-yl]morpholine
CID 154575674
4-[[6-(2-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazol-3-yl]methyl]morpholine
CID 59680036
4-[[2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)phenyl]methyl]morpholine
CID 50974345
2-morpholin-4-yl-6-[2-(morpholin-4-ylmethyl)phenyl]pyrimidin-4-amine
CID 74235769
4-[(2-bromo-3-pyridinyl)methyl]morpholine
CID 23438103
4-(2,6-dimethyl-3-pyridinyl)-N-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine
CID 56863565

Frequently Asked Questions

What is the IUPAC name of 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine?
The IUPAC name of 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine (CID 56872749) is 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine.
What is the SMILES notation for 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine?
The canonical SMILES for 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine is Cc1ccc(-c2ccnc(-c3ccccc3CN3CCOCC3)n2)c(C)n1.
What is the InChIKey of 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine?
The InChIKey is ZBWIMDUDWWGQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O/c1-16-7-8-19(17(2)24-16)21-9-10-23-22(25-21)20-6-4-3-5-18(20)15-26-11-13-27-14-12-26/h3-10H,11-15H2,1-2H3.
What are the key properties of 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine?
4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine has a molecular weight of 360.46 g/mol, XLogP of 3.65, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine is sourced from PubChem (CID 56872749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).