4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine

C22H23N7O2 — CID 165414883

IUPAC4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine
SMILESCn1cc(-c2ccccc2)nc1COc1cc(N2CCOCC2)nc(-c2ccn[nH]2)n1
InChIInChI=1S/C22H23N7O2/c1-28-14-18(16-5-3-2-4-6-16)24-20(28)15-31-21-13-19(29-9-11-30-12-10-29)25-22(26-21)17-7-8-23-27-17/h2-8,13-14H,9-12,15H2,1H3,(H,23,27)
InChIKeyQCSZFZMUEZWVJO-UHFFFAOYSA-N
MW417.47 g/mol
LogP2.68
Rot. Bonds6

About 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine

4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine (PubChem CID 165414883) has the molecular formula C22H23N7O2 and a molecular weight of 417.47 g/mol. Its IUPAC name is 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine
PubChem CID165414883
Molecular FormulaC22H23N7O2
Molecular Weight417.47 g/mol
Exact Mass417.19
IUPAC Name4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine
SMILESCn1cc(-c2ccccc2)nc1COc1cc(N2CCOCC2)nc(-c2ccn[nH]2)n1
InChIInChI=1S/C22H23N7O2/c1-28-14-18(16-5-3-2-4-6-16)24-20(28)15-31-21-13-19(29-9-11-30-12-10-29)25-22(26-21)17-7-8-23-27-17/h2-8,13-14H,9-12,15H2,1H3,(H,23,27)
InChIKeyQCSZFZMUEZWVJO-UHFFFAOYSA-N
XLogP2.68
TPSA93.98 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.47
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-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

Related Compounds

2-(4-(2-(1H-imidazol-1-yl)ethoxy)phenyl)-4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridine
CID 10294883
Idrx-42
CID 155587867
US10399985, Example 38
CID 118288258
US10399985, Example 46
CID 122693994
N-[[4-(2-methyltriazol-4-yl)phenyl]methyl]-6-[7-(3-pyrrolidin-1-ylpropoxy)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine
CID 155587470
6-(7-Methoxyimidazo[1,2-a]pyridin-3-yl)-N-[[4-(2-methyl-2H-1,2,3-triazol-4-yl)phenyl]methyl]-4-pyrimidinamine
CID 155587672
6-[7-[(1-methylazetidin-3-yl)methoxy]imidazo[1,2-a]pyridin-3-yl]-N-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]pyrimidin-4-amine
CID 155587755
N-[[4-(2-methyltriazol-4-yl)phenyl]methyl]-6-[7-[2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)ethoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine
CID 155587847
6-(7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]pyrimidin-4-amine
CID 155587884
N-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]-6-[7-(oxolan-3-yloxy)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine
CID 157374160
6-[7-[[1-(2-methoxyethyl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]-N-[[4-(2-methyltriazol-4-yl)phenyl]methyl]pyrimidin-4-amine
CID 160332084
4-[6-[(1-Methyl-4-phenylimidazol-2-yl)methoxy]-2-pyridin-3-ylpyrimidin-4-yl]morpholine
CID 165414975

Frequently Asked Questions

What is the IUPAC name of 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine (CID 165414883) is 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine is Cn1cc(-c2ccccc2)nc1COc1cc(N2CCOCC2)nc(-c2ccn[nH]2)n1.
What is the InChIKey of 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine?
The InChIKey is QCSZFZMUEZWVJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N7O2/c1-28-14-18(16-5-3-2-4-6-16)24-20(28)15-31-21-13-19(29-9-11-30-12-10-29)25-22(26-21)17-7-8-23-27-17/h2-8,13-14H,9-12,15H2,1H3,(H,23,27).
What are the key properties of 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine?
4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine has a molecular weight of 417.47 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-2-(1H-pyrazol-5-yl)pyrimidin-4-yl]morpholine is sourced from PubChem (CID 165414883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).