(1,2,3-trimethyl-2H-imidazol-4-yl)methanol

C7H14N2O — CID 67521278

IUPAC(1,2,3-trimethyl-2H-imidazol-4-yl)methanol
SMILESCC1N(C)C=C(CO)N1C
InChIInChI=1S/C7H14N2O/c1-6-8(2)4-7(5-10)9(6)3/h4,6,10H,5H2,1-3H3
InChIKeyRVJWDFJQLXKOQZ-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.04
Rot. Bonds1

About (1,2,3-trimethyl-2H-imidazol-4-yl)methanol

(1,2,3-trimethyl-2H-imidazol-4-yl)methanol (PubChem CID 67521278) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is (1,2,3-trimethyl-2H-imidazol-4-yl)methanol.

Molecular Properties

Compound Name(1,2,3-trimethyl-2H-imidazol-4-yl)methanol
PubChem CID67521278
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name(1,2,3-trimethyl-2H-imidazol-4-yl)methanol
SMILESCC1N(C)C=C(CO)N1C
InChIInChI=1S/C7H14N2O/c1-6-8(2)4-7(5-10)9(6)3/h4,6,10H,5H2,1-3H3
InChIKeyRVJWDFJQLXKOQZ-UHFFFAOYSA-N
XLogP0.04
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(dimethylamino)-1,3-dimethyl-2H-imidazol-4-yl]methanol
CID 23026367
4-[5-(hydroxymethyl)-3-methyl-2H-imidazol-1-yl]butanenitrile
CID 57225883
(3-Ethyl-1,2-dihydroimidazol-4-yl)methanol
CID 126624535
(2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol
CID 141116737
(1-tert-butyl-3-methyl-2H-imidazol-4-yl)methanol
CID 156037502
(2-methyl-2,3-dihydro-1H-imidazol-4-yl)methanol
CID 86340537
(2-ethyl-2,3-dihydro-1H-imidazol-4-yl)methanol
CID 86340940
2-(4-Methyl-1,2-dihydroimidazol-3-yl)ethanol
CID 86341091
(2-Amino-3-methyl-1,2-dihydroimidazol-4-yl)methanol
CID 86341547
(1,3-diethyl-4-methyl-2H-imidazol-2-yl)methanol
CID 118386603
4-(Hydroxymethyl)-1,3-dimethyl-2,3-dihydro-1H-imidazol-2-one
CID 124707036
1-Ethyl-4-(hydroxymethyl)-3-methyl-2,3-dihydro-1H-imidazol-2-one
CID 125457192

Frequently Asked Questions

What is the IUPAC name of (1,2,3-trimethyl-2H-imidazol-4-yl)methanol?
The IUPAC name of (1,2,3-trimethyl-2H-imidazol-4-yl)methanol (CID 67521278) is (1,2,3-trimethyl-2H-imidazol-4-yl)methanol.
What is the SMILES notation for (1,2,3-trimethyl-2H-imidazol-4-yl)methanol?
The canonical SMILES for (1,2,3-trimethyl-2H-imidazol-4-yl)methanol is CC1N(C)C=C(CO)N1C.
What is the InChIKey of (1,2,3-trimethyl-2H-imidazol-4-yl)methanol?
The InChIKey is RVJWDFJQLXKOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-6-8(2)4-7(5-10)9(6)3/h4,6,10H,5H2,1-3H3.
What are the key properties of (1,2,3-trimethyl-2H-imidazol-4-yl)methanol?
(1,2,3-trimethyl-2H-imidazol-4-yl)methanol has a molecular weight of 142.20 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2,3-trimethyl-2H-imidazol-4-yl)methanol is sourced from PubChem (CID 67521278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).