4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine

C15H18N2O — CID 157209646

IUPAC4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine
SMILESCOc1nc(C)ncc1-c1ccc(C(C)C)cc1
InChIInChI=1S/C15H18N2O/c1-10(2)12-5-7-13(8-6-12)14-9-16-11(3)17-15(14)18-4/h5-10H,1-4H3
InChIKeyAIAOBFQZIQZWNR-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.58
Rot. Bonds3

About 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine

4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine (PubChem CID 157209646) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine.

Molecular Properties

Compound Name4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine
PubChem CID157209646
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine
SMILESCOc1nc(C)ncc1-c1ccc(C(C)C)cc1
InChIInChI=1S/C15H18N2O/c1-10(2)12-5-7-13(8-6-12)14-9-16-11(3)17-15(14)18-4/h5-10H,1-4H3
InChIKeyAIAOBFQZIQZWNR-UHFFFAOYSA-N
XLogP3.58
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethoxy-5-(4-methylphenyl)pyrimidine
CID 90464410
4,6-dimethoxy-5-(4-propan-2-ylphenyl)pyrimidine
CID 139331961
(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol
CID 104514527
4-methoxy-5-[4-(4-methylpyridazin-3-yl)phenyl]pyrimidin-2-amine
CID 155404797
4-chloro-2-methyl-5-phenylpyrimidine
CID 19917991
1-methyl-4-propan-2-ylbenzene;ruthenium;dihydroiodide
CID 175953909
(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethanamine
CID 67245959
[4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol
CID 157209645
carbanide;1-methoxy-4-propan-2-ylbenzene;yttrium
CID 157263215
2,6-dimethyl-4-(4-propan-2-ylphenyl)pyridine
CID 176864859
2-fluoro-1,3-dimethyl-4-(4-propan-2-ylphenyl)benzene
CID 58689096
1-methoxy-4-propan-2-ylbenzene;1-(2-methylpropoxy)-4-propan-2-ylbenzene
CID 163393243

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine?
The IUPAC name of 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine (CID 157209646) is 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine.
What is the SMILES notation for 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine?
The canonical SMILES for 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine is COc1nc(C)ncc1-c1ccc(C(C)C)cc1.
What is the InChIKey of 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine?
The InChIKey is AIAOBFQZIQZWNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-10(2)12-5-7-13(8-6-12)14-9-16-11(3)17-15(14)18-4/h5-10H,1-4H3.
What are the key properties of 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine?
4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine has a molecular weight of 242.32 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine is sourced from PubChem (CID 157209646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).