[4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol

C6H10N2O2 — CID 10920614

IUPAC[4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol
SMILESCc1nc(CO)c(CO)[nH]1
InChIInChI=1S/C6H10N2O2/c1-4-7-5(2-9)6(3-10)8-4/h9-10H,2-3H2,1H3,(H,7,8)
InChIKeyCIZIDJCTTRZYBO-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.30
Rot. Bonds2

About [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol

[4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol (PubChem CID 10920614) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol.

Molecular Properties

Compound Name[4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol
PubChem CID10920614
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name[4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol
SMILESCc1nc(CO)c(CO)[nH]1
InChIInChI=1S/C6H10N2O2/c1-4-7-5(2-9)6(3-10)8-4/h9-10H,2-3H2,1H3,(H,7,8)
InChIKeyCIZIDJCTTRZYBO-UHFFFAOYSA-N
XLogP-0.30
TPSA69.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol?
The IUPAC name of [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol (CID 10920614) is [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol.
What is the SMILES notation for [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol?
The canonical SMILES for [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol is Cc1nc(CO)c(CO)[nH]1.
What is the InChIKey of [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol?
The InChIKey is CIZIDJCTTRZYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-4-7-5(2-9)6(3-10)8-4/h9-10H,2-3H2,1H3,(H,7,8).
What are the key properties of [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol?
[4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol has a molecular weight of 142.16 g/mol, XLogP of -0.30, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol is sourced from PubChem (CID 10920614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).