(3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol

C14H16N2O2 — CID 102950429

IUPAC(3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol
SMILESCCc1cccc(C(O)c2cc(OC)ncn2)c1
InChIInChI=1S/C14H16N2O2/c1-3-10-5-4-6-11(7-10)14(17)12-8-13(18-2)16-9-15-12/h4-9,14,17H,3H2,1-2H3
InChIKeyPFFBBEJPFOMVIA-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.13
Rot. Bonds4

About (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol

(3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol (PubChem CID 102950429) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol.

Molecular Properties

Compound Name(3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol
PubChem CID102950429
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name(3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol
SMILESCCc1cccc(C(O)c2cc(OC)ncn2)c1
InChIInChI=1S/C14H16N2O2/c1-3-10-5-4-6-11(7-10)14(17)12-8-13(18-2)16-9-15-12/h4-9,14,17H,3H2,1-2H3
InChIKeyPFFBBEJPFOMVIA-UHFFFAOYSA-N
XLogP2.13
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950226
(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950306
(4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950531
2-(4-ethylphenyl)-1-(6-methoxypyrimidin-4-yl)-N-methylethanamine
CID 102951077
(3-ethylphenyl)-(2-methyl-3-pyridinyl)methanol
CID 105117216
N-ethyl-2-(4-ethylphenyl)-1-(6-methoxypyrimidin-4-yl)ethanamine
CID 102951640
(3,5-dibromophenyl)-(3-ethylphenyl)methanol
CID 107978572
(5-chlorofuran-2-yl)-(3-ethylphenyl)methanol
CID 106693920
1-(6-methoxypyrimidin-4-yl)-N-methyl-1-(3-methylphenyl)methanamine
CID 102951074
2-ethoxy-1-(6-methoxypyrimidin-4-yl)ethanamine
CID 102950788
1-(3-ethylphenyl)-3-methoxy-2-methylpropan-1-ol
CID 116502579
1-(3-ethylphenyl)-2-methoxybutan-1-ol
CID 116710803

Frequently Asked Questions

What is the IUPAC name of (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The IUPAC name of (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol (CID 102950429) is (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol.
What is the SMILES notation for (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The canonical SMILES for (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol is CCc1cccc(C(O)c2cc(OC)ncn2)c1.
What is the InChIKey of (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The InChIKey is PFFBBEJPFOMVIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-3-10-5-4-6-11(7-10)14(17)12-8-13(18-2)16-9-15-12/h4-9,14,17H,3H2,1-2H3.
What are the key properties of (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol?
(3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol has a molecular weight of 244.29 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol is sourced from PubChem (CID 102950429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).