(1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol

C14H18N2O2 — CID 63974299

IUPAC(1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol
SMILESCC(C)Oc1ccc(C(O)c2nccn2C)cc1
InChIInChI=1S/C14H18N2O2/c1-10(2)18-12-6-4-11(5-7-12)13(17)14-15-8-9-16(14)3/h4-10,13,17H,1-3H3
InChIKeyMMLRCGNZTRLZLF-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.29
Rot. Bonds4

About (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol

(1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol (PubChem CID 63974299) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol.

Molecular Properties

Compound Name(1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol
PubChem CID63974299
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name(1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol
SMILESCC(C)Oc1ccc(C(O)c2nccn2C)cc1
InChIInChI=1S/C14H18N2O2/c1-10(2)18-12-6-4-11(5-7-12)13(17)14-15-8-9-16(14)3/h4-10,13,17H,1-3H3
InChIKeyMMLRCGNZTRLZLF-UHFFFAOYSA-N
XLogP2.29
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(S)-(4-fluorophenyl)-(1-methylimidazol-2-yl)methanol
CID 26722436
[4-(diethylamino)phenyl]-(1-methylimidazol-2-yl)methanol
CID 23797851
(2-methylpyrazol-3-yl)-(4-propan-2-yloxyphenyl)methanol
CID 63961352
(2,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methanol
CID 2891507
(3-chloro-4-methylphenyl)-(1-methylimidazol-2-yl)methanol
CID 63195009
methane;1-(1-methylimidazol-2-yl)ethanol
CID 174578222
[2-[4-[hydroxy-(1-methylimidazol-2-yl)methyl]phenyl]-3H-benzimidazol-5-yl] carbamate
CID 69342788
[3-(dimethylamino)phenyl]-(1-methylimidazol-2-yl)methanol
CID 105098831
(1R)-1-(3-fluorophenyl)-1-(1-methylimidazol-2-yl)-N-[(4-propan-2-yloxyphenyl)methyl]methanamine
CID 94193697
(2R)-1-(1-methylimidazol-2-yl)propane-1,2-diol;hydrochloride
CID 173103248
(2,3-dimethoxyphenyl)-(1-methylimidazol-2-yl)methanol
CID 2870378
1-methyl-2-propan-2-yloxyimidazole
CID 59139379

Frequently Asked Questions

What is the IUPAC name of (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol?
The IUPAC name of (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol (CID 63974299) is (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol.
What is the SMILES notation for (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol?
The canonical SMILES for (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol is CC(C)Oc1ccc(C(O)c2nccn2C)cc1.
What is the InChIKey of (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol?
The InChIKey is MMLRCGNZTRLZLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-10(2)18-12-6-4-11(5-7-12)13(17)14-15-8-9-16(14)3/h4-10,13,17H,1-3H3.
What are the key properties of (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol?
(1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol has a molecular weight of 246.31 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylimidazol-2-yl)-(4-propan-2-yloxyphenyl)methanol is sourced from PubChem (CID 63974299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).