1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol

C9H16N2O2 — CID 79616649

IUPAC1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol
SMILESCCn1ccnc1C(O)C(C)OC
InChIInChI=1S/C9H16N2O2/c1-4-11-6-5-10-9(11)8(12)7(2)13-3/h5-8,12H,4H2,1-3H3
InChIKeyOEUCFXYMVRKFHW-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.97
Rot. Bonds4

About 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol

1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol (PubChem CID 79616649) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol.

Molecular Properties

Compound Name1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol
PubChem CID79616649
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol
SMILESCCn1ccnc1C(O)C(C)OC
InChIInChI=1S/C9H16N2O2/c1-4-11-6-5-10-9(11)8(12)7(2)13-3/h5-8,12H,4H2,1-3H3
InChIKeyOEUCFXYMVRKFHW-UHFFFAOYSA-N
XLogP0.97
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethylimidazol-2-yl)-3,3-dimethylbutane-1,2-diol
CID 103457324
2-ethoxy-1-(1-ethylimidazol-2-yl)-3-methylbutan-1-ol
CID 116712316
1-cyclopropyl-2-(1-ethylimidazol-2-yl)ethane-1,2-diol
CID 103456993
3-(1-ethylimidazol-2-yl)-2,3-dihydroxypropanamide
CID 171869595
2-(1-bromoethyl)-1-ethylimidazole
CID 71635251
1-(1-ethylimidazol-2-yl)ethanamine
CID 63970415
1-ethyl-2-[(1R)-1-iodoethyl]imidazole
CID 97177373
2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol
CID 116757187
1-(1-ethylimidazol-2-yl)-2,2-dimethylbutan-1-ol
CID 115800026
2-butan-2-ylsulfanyl-1-(1-ethylimidazol-2-yl)ethanol
CID 65136113
[1-(1-ethylimidazol-2-yl)-2,2-dimethoxyethyl]hydrazine
CID 105245886
3-ethoxy-1-(1-ethylimidazol-2-yl)propan-1-ol
CID 105099040

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol?
The IUPAC name of 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol (CID 79616649) is 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol.
What is the SMILES notation for 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol?
The canonical SMILES for 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol is CCn1ccnc1C(O)C(C)OC.
What is the InChIKey of 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol?
The InChIKey is OEUCFXYMVRKFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-4-11-6-5-10-9(11)8(12)7(2)13-3/h5-8,12H,4H2,1-3H3.
What are the key properties of 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol?
1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol has a molecular weight of 184.24 g/mol, XLogP of 0.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol is sourced from PubChem (CID 79616649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).