[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol

C16H20N2O — CID 116893839

IUPAC[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol
SMILESCc1cc(-c2cc(C(C)C)ccc2C)nc(CO)n1
InChIInChI=1S/C16H20N2O/c1-10(2)13-6-5-11(3)14(8-13)15-7-12(4)17-16(9-19)18-15/h5-8,10,19H,9H2,1-4H3
InChIKeyWOZHPDCBMUHVNR-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.38
Rot. Bonds3

About [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol

[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol (PubChem CID 116893839) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol.

Molecular Properties

Compound Name[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol
PubChem CID116893839
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol
SMILESCc1cc(-c2cc(C(C)C)ccc2C)nc(CO)n1
InChIInChI=1S/C16H20N2O/c1-10(2)13-6-5-11(3)14(8-13)15-7-12(4)17-16(9-19)18-15/h5-8,10,19H,9H2,1-4H3
InChIKeyWOZHPDCBMUHVNR-UHFFFAOYSA-N
XLogP3.38
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanamine
CID 82482338
2-[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]acetonitrile
CID 116895043
4-(2-methyl-5-propan-2-ylphenyl)pyrimidine-2-carboxylic acid
CID 116899759
1-[4-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-yl]ethanol
CID 116867576
4-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-amine
CID 82495942
4-(2-methyl-5-propan-2-ylphenyl)phenol
CID 151746189
2-(chloromethyl)-4-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazole
CID 116867853
2-(bromomethyl)-4-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazole
CID 116970332
1,4-dimethyl-6-propan-2-ylazulene
CID 19861187
4-(2-methoxy-4-propan-2-ylphenyl)-6-methylpyrimidin-2-amine
CID 82300071
2-bromo-6-(2-methyl-5-propan-2-ylphenyl)imidazo[1,2-b]pyridazine
CID 116854791
[4-(4-ethoxyphenyl)-6-methylpyrimidin-2-yl]methanol
CID 116893816

Frequently Asked Questions

What is the IUPAC name of [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol?
The IUPAC name of [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol (CID 116893839) is [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol.
What is the SMILES notation for [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol?
The canonical SMILES for [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol is Cc1cc(-c2cc(C(C)C)ccc2C)nc(CO)n1.
What is the InChIKey of [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol?
The InChIKey is WOZHPDCBMUHVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-10(2)13-6-5-11(3)14(8-13)15-7-12(4)17-16(9-19)18-15/h5-8,10,19H,9H2,1-4H3.
What are the key properties of [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol?
[4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol has a molecular weight of 256.35 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-6-(2-methyl-5-propan-2-ylphenyl)pyrimidin-2-yl]methanol is sourced from PubChem (CID 116893839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).