(1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol

C15H18N2O — CID 103431391

IUPAC(1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol
SMILESCc1ccccc1Cc1ncc([C@@H](C)O)c(C)n1
InChIInChI=1S/C15H18N2O/c1-10-6-4-5-7-13(10)8-15-16-9-14(12(3)18)11(2)17-15/h4-7,9,12,18H,8H2,1-3H3/t12-/m1/s1
InChIKeyAYAWCZXKYSDIFU-GFCCVEGCSA-N
MW242.32 g/mol
LogP2.74
Rot. Bonds3

About (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol

(1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol (PubChem CID 103431391) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol
PubChem CID103431391
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name(1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol
SMILESCc1ccccc1Cc1ncc([C@@H](C)O)c(C)n1
InChIInChI=1S/C15H18N2O/c1-10-6-4-5-7-13(10)8-15-16-9-14(12(3)18)11(2)17-15/h4-7,9,12,18H,8H2,1-3H3/t12-/m1/s1
InChIKeyAYAWCZXKYSDIFU-GFCCVEGCSA-N
XLogP2.74
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol
CID 62770681
(1S)-1-[2-[(2-fluorophenyl)methyl]-4-methylpyrimidin-5-yl]ethanol
CID 103431425
1-[2-[(3-chloro-2-fluorophenyl)methyl]-4-methylpyrimidin-5-yl]ethanol
CID 82806358
(1R)-1-[2-[(3-chloro-2-fluorophenyl)methyl]-4-methylpyrimidin-5-yl]ethanol
CID 103431246
(1S)-1-[2-[(3,5-dimethylphenyl)methyl]-4-methylpyrimidin-5-yl]ethanol
CID 103431528
1-[2-[(4-methoxyphenyl)methyl]-4-methylpyrimidin-5-yl]ethanol
CID 62770507
(1R)-1-[2-[(2-chlorophenyl)sulfanylmethyl]-4-methylpyrimidin-5-yl]ethanol
CID 103431412
(1S)-1-[4-methyl-2-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-5-yl]ethanol
CID 94607488
(1S)-1-[2-[(2-methoxyphenyl)methyl]-4-methylpyrimidin-5-yl]ethanamine
CID 103432032
(1S)-1-[2-(3-methoxypropyl)-4-methylpyrimidin-5-yl]ethanol
CID 103431529
4-methyl-2-[(2-methylphenyl)methyl]pyrimidine
CID 21028246
4-amino-2-[(2-methylphenyl)methyl]pyrimidine-5-carboxamide
CID 116647848

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol?
The IUPAC name of (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol (CID 103431391) is (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol.
What is the SMILES notation for (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol?
The canonical SMILES for (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol is Cc1ccccc1Cc1ncc([C@@H](C)O)c(C)n1.
What is the InChIKey of (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol?
The InChIKey is AYAWCZXKYSDIFU-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H18N2O/c1-10-6-4-5-7-13(10)8-15-16-9-14(12(3)18)11(2)17-15/h4-7,9,12,18H,8H2,1-3H3/t12-/m1/s1.
What are the key properties of (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol?
(1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol has a molecular weight of 242.32 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-methyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]ethanol is sourced from PubChem (CID 103431391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).