2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine

C13H17N5O — CID 132775431

IUPAC2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine
SMILESCc1nccc(N2CCOC(c3ncc(C)[nH]3)C2)n1
InChIInChI=1S/C13H17N5O/c1-9-7-15-13(16-9)11-8-18(5-6-19-11)12-3-4-14-10(2)17-12/h3-4,7,11H,5-6,8H2,1-2H3,(H,15,16)
InChIKeyQCVUPZYKCPTVFP-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.39
Rot. Bonds2

About 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine

2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine (PubChem CID 132775431) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine
PubChem CID132775431
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine
SMILESCc1nccc(N2CCOC(c3ncc(C)[nH]3)C2)n1
InChIInChI=1S/C13H17N5O/c1-9-7-15-13(16-9)11-8-18(5-6-19-11)12-3-4-14-10(2)17-12/h3-4,7,11H,5-6,8H2,1-2H3,(H,15,16)
InChIKeyQCVUPZYKCPTVFP-UHFFFAOYSA-N
XLogP1.39
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine?
The IUPAC name of 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine (CID 132775431) is 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine.
What is the SMILES notation for 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine?
The canonical SMILES for 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine is Cc1nccc(N2CCOC(c3ncc(C)[nH]3)C2)n1.
What is the InChIKey of 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine?
The InChIKey is QCVUPZYKCPTVFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-9-7-15-13(16-9)11-8-18(5-6-19-11)12-3-4-14-10(2)17-12/h3-4,7,11H,5-6,8H2,1-2H3,(H,15,16).
What are the key properties of 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine?
2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine has a molecular weight of 259.31 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 132775431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).