2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol

C8H16N2O — CID 148793871

IUPAC2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol
SMILESCN1C=CN(C(C)(C)CO)C1
InChIInChI=1S/C8H16N2O/c1-8(2,6-11)10-5-4-9(3)7-10/h4-5,11H,6-7H2,1-3H3
InChIKeyOMSFEQDYQPNNOP-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.43
Rot. Bonds2

About 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol

2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol (PubChem CID 148793871) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol
PubChem CID148793871
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol
SMILESCN1C=CN(C(C)(C)CO)C1
InChIInChI=1S/C8H16N2O/c1-8(2,6-11)10-5-4-9(3)7-10/h4-5,11H,6-7H2,1-3H3
InChIKeyOMSFEQDYQPNNOP-UHFFFAOYSA-N
XLogP0.43
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol?
The IUPAC name of 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol (CID 148793871) is 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol?
The canonical SMILES for 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol is CN1C=CN(C(C)(C)CO)C1.
What is the InChIKey of 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol?
The InChIKey is OMSFEQDYQPNNOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-8(2,6-11)10-5-4-9(3)7-10/h4-5,11H,6-7H2,1-3H3.
What are the key properties of 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol?
2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol has a molecular weight of 156.23 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(3-methyl-2H-imidazol-1-yl)propan-1-ol is sourced from PubChem (CID 148793871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).