2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol

C14H18N2O — CID 114495862

IUPAC2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol
SMILESCCC(C)(O)Cn1ccnc1-c1ccccc1
InChIInChI=1S/C14H18N2O/c1-3-14(2,17)11-16-10-9-15-13(16)12-7-5-4-6-8-12/h4-10,17H,3,11H2,1-2H3
InChIKeyNAOWHLULPVJLII-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.71
Rot. Bonds4

About 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol

2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol (PubChem CID 114495862) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol
PubChem CID114495862
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol
SMILESCCC(C)(O)Cn1ccnc1-c1ccccc1
InChIInChI=1S/C14H18N2O/c1-3-14(2,17)11-16-10-9-15-13(16)12-7-5-4-6-8-12/h4-10,17H,3,11H2,1-2H3
InChIKeyNAOWHLULPVJLII-UHFFFAOYSA-N
XLogP2.71
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,2-dimethylpropyl)-2-phenylimidazole
CID 21060212
2-methyl-N-[2-(2-phenylimidazol-1-yl)ethyl]butan-2-amine
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1-(2-phenylimidazol-1-yl)butan-2-ol
CID 58743669
1-(2-phenylimidazol-1-yl)propan-2-ol
CID 58743625
2-(2-phenylimidazol-1-yl)acetic acid
CID 3145945
2-(ethylamino)-2-methyl-4-(2-phenylimidazol-1-yl)butan-1-ol
CID 64810293
1-(2-phenylimidazol-1-yl)pentan-2-ol
CID 62043887
4-[(2-phenylimidazol-1-yl)methyl]pyridine
CID 67150298
trifluoro-[3-(2-phenylimidazol-1-yl)prop-1-en-2-yl]boranuide
CID 106746348
2-(2-phenylimidazol-1-yl)acetate
CID 7446830
2-(2-phenylimidazol-1-yl)ethanethioamide
CID 61069936
N-tert-butyl-4-(2-phenylimidazol-1-yl)butan-1-amine
CID 62566993

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol?
The IUPAC name of 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol (CID 114495862) is 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol.
What is the SMILES notation for 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol?
The canonical SMILES for 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol is CCC(C)(O)Cn1ccnc1-c1ccccc1.
What is the InChIKey of 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol?
The InChIKey is NAOWHLULPVJLII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-3-14(2,17)11-16-10-9-15-13(16)12-7-5-4-6-8-12/h4-10,17H,3,11H2,1-2H3.
What are the key properties of 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol?
2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol has a molecular weight of 230.31 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-phenylimidazol-1-yl)butan-2-ol is sourced from PubChem (CID 114495862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).