[2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol

C15H18N2O2 — CID 115070027

IUPAC[2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol
SMILESCOc1ccccc1Cc1nc(C)c(CO)c(C)n1
InChIInChI=1S/C15H18N2O2/c1-10-13(9-18)11(2)17-15(16-10)8-12-6-4-5-7-14(12)19-3/h4-7,18H,8-9H2,1-3H3
InChIKeyHZRDPHSZQHZVIH-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.19
Rot. Bonds4

About [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol

[2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol (PubChem CID 115070027) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol
PubChem CID115070027
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name[2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol
SMILESCOc1ccccc1Cc1nc(C)c(CO)c(C)n1
InChIInChI=1S/C15H18N2O2/c1-10-13(9-18)11(2)17-15(16-10)8-12-6-4-5-7-14(12)19-3/h4-7,18H,8-9H2,1-3H3
InChIKeyHZRDPHSZQHZVIH-UHFFFAOYSA-N
XLogP2.19
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]propan-1-amine
CID 62746485
methyl 4-amino-2-[(2-methoxyphenyl)methyl]-6-methylpyrimidine-5-carboxylate
CID 116647642
[2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol
CID 62757708
(2-(111C)methoxyphenyl)methanol
CID 59897789
[2-[(2-methoxyphenyl)methyl]-6-methylpyrimidin-4-yl]methanamine
CID 62743741
[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]methanol
CID 117098962
(1S)-1-[2-[(2-methoxyphenyl)methyl]-4-methylpyrimidin-5-yl]ethanamine
CID 103432032
[4-[(2-methoxyphenyl)methyl]phenyl]methanol
CID 54205335
N-ethyl-1-[2-[(2-methoxyphenyl)methyl]-4-methylpyrimidin-5-yl]ethanamine
CID 62771730
4-chloro-6-cyclopropyl-2-[(2-methoxyphenyl)methyl]pyrimidine
CID 63355445
2-[2-[(2-methoxyphenyl)methyl]-4-methyl-1,3-thiazol-5-yl]acetic acid
CID 64661687
2-[5-[(2-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl]ethanol
CID 115078940

Frequently Asked Questions

What is the IUPAC name of [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol?
The IUPAC name of [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol (CID 115070027) is [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol.
What is the SMILES notation for [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol?
The canonical SMILES for [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol is COc1ccccc1Cc1nc(C)c(CO)c(C)n1.
What is the InChIKey of [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol?
The InChIKey is HZRDPHSZQHZVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10-13(9-18)11(2)17-15(16-10)8-12-6-4-5-7-14(12)19-3/h4-7,18H,8-9H2,1-3H3.
What are the key properties of [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol?
[2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol has a molecular weight of 258.32 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol is sourced from PubChem (CID 115070027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).