(2-butyl-1H-imidazol-5-yl)methanol

C8H14N2O — CID 2735673

IUPAC(2-butyl-1H-imidazol-5-yl)methanol
SMILESCCCCc1ncc(CO)[nH]1
InChIInChI=1S/C8H14N2O/c1-2-3-4-8-9-5-7(6-11)10-8/h5,11H,2-4,6H2,1H3,(H,9,10)
InChIKeyUZKBZGAMRJRWLR-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.24
Rot. Bonds4

About (2-butyl-1H-imidazol-5-yl)methanol

(2-butyl-1H-imidazol-5-yl)methanol (PubChem CID 2735673) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is (2-butyl-1H-imidazol-5-yl)methanol.

Molecular Properties

Compound Name(2-butyl-1H-imidazol-5-yl)methanol
PubChem CID2735673
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name(2-butyl-1H-imidazol-5-yl)methanol
SMILESCCCCc1ncc(CO)[nH]1
InChIInChI=1S/C8H14N2O/c1-2-3-4-8-9-5-7(6-11)10-8/h5,11H,2-4,6H2,1H3,(H,9,10)
InChIKeyUZKBZGAMRJRWLR-UHFFFAOYSA-N
XLogP1.24
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-butyl-1H-imidazol-5-yl)methanol?
The IUPAC name of (2-butyl-1H-imidazol-5-yl)methanol (CID 2735673) is (2-butyl-1H-imidazol-5-yl)methanol.
What is the SMILES notation for (2-butyl-1H-imidazol-5-yl)methanol?
The canonical SMILES for (2-butyl-1H-imidazol-5-yl)methanol is CCCCc1ncc(CO)[nH]1.
What is the InChIKey of (2-butyl-1H-imidazol-5-yl)methanol?
The InChIKey is UZKBZGAMRJRWLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-2-3-4-8-9-5-7(6-11)10-8/h5,11H,2-4,6H2,1H3,(H,9,10).
What are the key properties of (2-butyl-1H-imidazol-5-yl)methanol?
(2-butyl-1H-imidazol-5-yl)methanol has a molecular weight of 154.21 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-butyl-1H-imidazol-5-yl)methanol is sourced from PubChem (CID 2735673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).