(3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol

C15H20N2O2 — CID 2889570

IUPAC(3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol
SMILESCCCc1ncc(C(O)c2cccc(OC)c2)n1C
InChIInChI=1S/C15H20N2O2/c1-4-6-14-16-10-13(17(14)2)15(18)11-7-5-8-12(9-11)19-3/h5,7-10,15,18H,4,6H2,1-3H3
InChIKeyDPYXTTMTEAYPOR-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.46
Rot. Bonds5

About (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol

(3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol (PubChem CID 2889570) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol.

Molecular Properties

Compound Name(3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol
PubChem CID2889570
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name(3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol
SMILESCCCc1ncc(C(O)c2cccc(OC)c2)n1C
InChIInChI=1S/C15H20N2O2/c1-4-6-14-16-10-13(17(14)2)15(18)11-7-5-8-12(9-11)19-3/h5,7-10,15,18H,4,6H2,1-3H3
InChIKeyDPYXTTMTEAYPOR-UHFFFAOYSA-N
XLogP2.46
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol?
The IUPAC name of (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol (CID 2889570) is (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol.
What is the SMILES notation for (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol?
The canonical SMILES for (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol is CCCc1ncc(C(O)c2cccc(OC)c2)n1C.
What is the InChIKey of (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol?
The InChIKey is DPYXTTMTEAYPOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-6-14-16-10-13(17(14)2)15(18)11-7-5-8-12(9-11)19-3/h5,7-10,15,18H,4,6H2,1-3H3.
What are the key properties of (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol?
(3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol has a molecular weight of 260.34 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol is sourced from PubChem (CID 2889570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).