2,4-dimethoxy-6-methyl-5-phenylpyrimidine

C13H14N2O2 — CID 16732730

IUPAC2,4-dimethoxy-6-methyl-5-phenylpyrimidine
SMILESCOc1nc(C)c(-c2ccccc2)c(OC)n1
InChIInChI=1S/C13H14N2O2/c1-9-11(10-7-5-4-6-8-10)12(16-2)15-13(14-9)17-3/h4-8H,1-3H3
InChIKeyXBGYPGMCIDIGIT-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.47
Rot. Bonds3

About 2,4-dimethoxy-6-methyl-5-phenylpyrimidine

2,4-dimethoxy-6-methyl-5-phenylpyrimidine (PubChem CID 16732730) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2,4-dimethoxy-6-methyl-5-phenylpyrimidine.

Molecular Properties

Compound Name2,4-dimethoxy-6-methyl-5-phenylpyrimidine
PubChem CID16732730
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2,4-dimethoxy-6-methyl-5-phenylpyrimidine
SMILESCOc1nc(C)c(-c2ccccc2)c(OC)n1
InChIInChI=1S/C13H14N2O2/c1-9-11(10-7-5-4-6-8-10)12(16-2)15-13(14-9)17-3/h4-8H,1-3H3
InChIKeyXBGYPGMCIDIGIT-UHFFFAOYSA-N
XLogP2.47
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-Ethyl-5-(4-methoxyphenyl)pyrimidine-2,4-diamine
CID 13926986
1-(4-Methoxy-6-methylquinazolin-2-yl)guanidine
CID 600062
4-Methoxyquinazoline
CID 27831
6-(4-Methoxyphenyl)pyrimidine-2,4-diamine
CID 2808121
2-(4-Ethoxy-8-methylquinazolin-2-yl)guanidine
CID 2869867
4-Chloro-6-(2-Methoxyphenyl)pyrimidin-2-Amine
CID 46861552
6-Ethyl-5-[3-(5-Methoxybiphenyl-3-Yl)prop-1-Yn-1-Yl]pyrimidine-2,4-Diamine
CID 49788718
(4-Methoxy-6-methyl-2-phenyl-pyrimidin-5-yl)-acetic acid
CID 917407
N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(4-methoxyphenyl)ethyl]guanidine
CID 3013233
4-(4-Methoxyphenyl)-6-phenylpyrimidin-2-amine
CID 12293992
2-(4-Methoxy-8-methylquinazolin-2-yl)guanidine
CID 3135990
6-Ethyl-5-(3-methoxy-phenyl)-pyrimidine-2,4-diamine
CID 10466996

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-6-methyl-5-phenylpyrimidine?
The IUPAC name of 2,4-dimethoxy-6-methyl-5-phenylpyrimidine (CID 16732730) is 2,4-dimethoxy-6-methyl-5-phenylpyrimidine.
What is the SMILES notation for 2,4-dimethoxy-6-methyl-5-phenylpyrimidine?
The canonical SMILES for 2,4-dimethoxy-6-methyl-5-phenylpyrimidine is COc1nc(C)c(-c2ccccc2)c(OC)n1.
What is the InChIKey of 2,4-dimethoxy-6-methyl-5-phenylpyrimidine?
The InChIKey is XBGYPGMCIDIGIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-9-11(10-7-5-4-6-8-10)12(16-2)15-13(14-9)17-3/h4-8H,1-3H3.
What are the key properties of 2,4-dimethoxy-6-methyl-5-phenylpyrimidine?
2,4-dimethoxy-6-methyl-5-phenylpyrimidine has a molecular weight of 230.27 g/mol, XLogP of 2.47, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-6-methyl-5-phenylpyrimidine is sourced from PubChem (CID 16732730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).