(3-methyl-2H-imidazol-1-yl)methanol;hydrochloride

C5H11ClN2O — CID 175484301

IUPAC(3-methyl-2H-imidazol-1-yl)methanol;hydrochloride
SMILESCN1C=CN(CO)C1.Cl
InChIInChI=1S/C5H10N2O.ClH/c1-6-2-3-7(4-6)5-8;/h2-3,8H,4-5H2,1H3;1H
InChIKeyVXTLOJWIZFDHBL-UHFFFAOYSA-N
MW150.61 g/mol
LogP0.03
Rot. Bonds1

About (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride

(3-methyl-2H-imidazol-1-yl)methanol;hydrochloride (PubChem CID 175484301) has the molecular formula C5H11ClN2O and a molecular weight of 150.61 g/mol. Its IUPAC name is (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride.

Molecular Properties

Compound Name(3-methyl-2H-imidazol-1-yl)methanol;hydrochloride
PubChem CID175484301
Molecular FormulaC5H11ClN2O
Molecular Weight150.61 g/mol
Exact Mass150.06
IUPAC Name(3-methyl-2H-imidazol-1-yl)methanol;hydrochloride
SMILESCN1C=CN(CO)C1.Cl
InChIInChI=1S/C5H10N2O.ClH/c1-6-2-3-7(4-6)5-8;/h2-3,8H,4-5H2,1H3;1H
InChIKeyVXTLOJWIZFDHBL-UHFFFAOYSA-N
XLogP0.03
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.61
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride?
The IUPAC name of (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride (CID 175484301) is (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride.
What is the SMILES notation for (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride?
The canonical SMILES for (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride is CN1C=CN(CO)C1.Cl.
What is the InChIKey of (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride?
The InChIKey is VXTLOJWIZFDHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O.ClH/c1-6-2-3-7(4-6)5-8;/h2-3,8H,4-5H2,1H3;1H.
What are the key properties of (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride?
(3-methyl-2H-imidazol-1-yl)methanol;hydrochloride has a molecular weight of 150.61 g/mol, XLogP of 0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-2H-imidazol-1-yl)methanol;hydrochloride is sourced from PubChem (CID 175484301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).