1,2-diethyl-3-methyl-2H-imidazole;quinoline

C17H23N3 — CID 159363401

IUPAC1,2-diethyl-3-methyl-2H-imidazole;quinoline
SMILESCCC1N(C)C=CN1CC.c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.C8H16N2/c1-2-6-9-8(4-1)5-3-7-10-9;1-4-8-9(3)6-7-10(8)5-2/h1-7H;6-8H,4-5H2,1-3H3
InChIKeyLIUWTAYBBNIZCT-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.70
Rot. Bonds2

About 1,2-diethyl-3-methyl-2H-imidazole;quinoline

1,2-diethyl-3-methyl-2H-imidazole;quinoline (PubChem CID 159363401) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 1,2-diethyl-3-methyl-2H-imidazole;quinoline.

Molecular Properties

Compound Name1,2-diethyl-3-methyl-2H-imidazole;quinoline
PubChem CID159363401
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name1,2-diethyl-3-methyl-2H-imidazole;quinoline
SMILESCCC1N(C)C=CN1CC.c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.C8H16N2/c1-2-6-9-8(4-1)5-3-7-10-9;1-4-8-9(3)6-7-10(8)5-2/h1-7H;6-8H,4-5H2,1-3H3
InChIKeyLIUWTAYBBNIZCT-UHFFFAOYSA-N
XLogP3.70
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(dimethylamino)-3-methyl-2H-imidazol-1-yl]ethanol;quinoline
CID 158024035
1,3-dibutyl-2H-imidazole-2-carbaldehyde;quinoline
CID 174389939
quinoline
CID 76974643
tris(1-ethyl-3-methyl-2H-imidazole);quinoline;tetrafluoroborate
CID 174804773
quinoline;tetramethylsilane
CID 91292784
osmium(2+);quinoline
CID 158407120
quinoline;silver
CID 88761492
CID 175273158
CID 175273158
hydron;quinoline
CID 131854096
CID 159709187
CID 159709187
platinum(2+);quinoline
CID 50910245
propan-1-ol;quinoline
CID 160910097

Frequently Asked Questions

What is the IUPAC name of 1,2-diethyl-3-methyl-2H-imidazole;quinoline?
The IUPAC name of 1,2-diethyl-3-methyl-2H-imidazole;quinoline (CID 159363401) is 1,2-diethyl-3-methyl-2H-imidazole;quinoline.
What is the SMILES notation for 1,2-diethyl-3-methyl-2H-imidazole;quinoline?
The canonical SMILES for 1,2-diethyl-3-methyl-2H-imidazole;quinoline is CCC1N(C)C=CN1CC.c1ccc2ncccc2c1.
What is the InChIKey of 1,2-diethyl-3-methyl-2H-imidazole;quinoline?
The InChIKey is LIUWTAYBBNIZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N.C8H16N2/c1-2-6-9-8(4-1)5-3-7-10-9;1-4-8-9(3)6-7-10(8)5-2/h1-7H;6-8H,4-5H2,1-3H3.
What are the key properties of 1,2-diethyl-3-methyl-2H-imidazole;quinoline?
1,2-diethyl-3-methyl-2H-imidazole;quinoline has a molecular weight of 269.39 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diethyl-3-methyl-2H-imidazole;quinoline is sourced from PubChem (CID 159363401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).