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

C8H15N3O — CID 15566034

IUPAC[2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol
SMILESCc1[nH]c(CN(C)C)nc1CO
InChIInChI=1S/C8H15N3O/c1-6-7(5-12)10-8(9-6)4-11(2)3/h12H,4-5H2,1-3H3,(H,9,10)
InChIKeyBZAGBVPLYKWKSZ-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.27
Rot. Bonds3

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

[2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol (PubChem CID 15566034) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol.

Molecular Properties

Compound Name[2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol
PubChem CID15566034
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name[2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol
SMILESCc1[nH]c(CN(C)C)nc1CO
InChIInChI=1S/C8H15N3O/c1-6-7(5-12)10-8(9-6)4-11(2)3/h12H,4-5H2,1-3H3,(H,9,10)
InChIKeyBZAGBVPLYKWKSZ-UHFFFAOYSA-N
XLogP0.27
TPSA52.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxymethyl-5-methyl-1H-imidazole
CID 122433
4-Methylimidazol-5-ylmethanolhydrochloride
CID 3084707
1H-Imidazole-4,5-dimethanol
CID 573629
hydron;(5-methyl-1H-imidazol-4-yl)methanol;chloride
CID 73994916
(4,5-dimethyl-1H-imidazol-2-yl)methanol
CID 46784770
4-Methylimidazole-2,5-diethanol
CID 541487
(2-Ethyl-5-methyl-1H-imidazol-4-yl)methanol
CID 13548606
(5-methyl-1H-imidazol-3-ium-4-yl)methanol chloride
CID 44660167
Hydroxymethylmethylnitroimidazole
CID 68968506
[2-fluoro-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol
CID 150748476
(5-methyl-1H-imidazol-3-ium-4-yl)methanol
CID 1391500
[2,4-bis(hydroxymethyl)-1H-imidazol-5-yl]methanol
CID 3703798

Frequently Asked Questions

What is the IUPAC name of [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol?
The IUPAC name of [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol (CID 15566034) is [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol.
What is the SMILES notation for [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol?
The canonical SMILES for [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol is Cc1[nH]c(CN(C)C)nc1CO.
What is the InChIKey of [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol?
The InChIKey is BZAGBVPLYKWKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-6-7(5-12)10-8(9-6)4-11(2)3/h12H,4-5H2,1-3H3,(H,9,10).
What are the key properties of [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol?
[2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol has a molecular weight of 169.23 g/mol, XLogP of 0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(dimethylamino)methyl]-5-methyl-1H-imidazol-4-yl]methanol is sourced from PubChem (CID 15566034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).