(5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol

C9H16N2O — CID 105433907

IUPAC(5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol
SMILESCCc1[nH]c(CO)nc1C(C)C
InChIInChI=1S/C9H16N2O/c1-4-7-9(6(2)3)11-8(5-12)10-7/h6,12H,4-5H2,1-3H3,(H,10,11)
InChIKeyJQISIQRURNUFET-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.59
Rot. Bonds3

About (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol

(5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol (PubChem CID 105433907) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol.

Molecular Properties

Compound Name(5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol
PubChem CID105433907
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name(5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol
SMILESCCc1[nH]c(CO)nc1C(C)C
InChIInChI=1S/C9H16N2O/c1-4-7-9(6(2)3)11-8(5-12)10-7/h6,12H,4-5H2,1-3H3,(H,10,11)
InChIKeyJQISIQRURNUFET-UHFFFAOYSA-N
XLogP1.59
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)methanol
CID 105430142
N-[(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)methyl]ethanamine
CID 114997302
[5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol
CID 105470027
[4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine
CID 105439692
2-(2-decyl-5-ethyl-1H-imidazol-4-yl)propanenitrile
CID 139791027
(2-amino-4-ethyl-1H-imidazol-5-yl)methanol
CID 22005602
(4-propan-2-yl-1H-imidazol-5-yl)methanol
CID 12615462
5-(chloromethyl)-2-methyl-4-propan-2-yl-1H-imidazole
CID 165441572
2-ethyl-5,6-dimethyl-3-propan-2-ylpyrazine
CID 89018232
2-ethyl-3-methyl-5,6-di(propan-2-yl)pyrazine
CID 70837931
[4-(2-chlorophenyl)-5-ethyl-1H-imidazol-2-yl]methanol
CID 105498426
(4-chloro-2-propan-2-yl-1H-imidazol-5-yl)methanol
CID 15338147

Frequently Asked Questions

What is the IUPAC name of (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol?
The IUPAC name of (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol (CID 105433907) is (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol.
What is the SMILES notation for (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol?
The canonical SMILES for (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol is CCc1[nH]c(CO)nc1C(C)C.
What is the InChIKey of (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol?
The InChIKey is JQISIQRURNUFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-4-7-9(6(2)3)11-8(5-12)10-7/h6,12H,4-5H2,1-3H3,(H,10,11).
What are the key properties of (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol?
(5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol has a molecular weight of 168.24 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol is sourced from PubChem (CID 105433907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).