2,5-dibutyl-4,5-dihydro-1H-imidazole

C11H22N2 — CID 88688688

IUPAC2,5-dibutyl-4,5-dihydro-1H-imidazole
SMILESCCCCC1=NCC(CCCC)N1
InChIInChI=1S/C11H22N2/c1-3-5-7-10-9-12-11(13-10)8-6-4-2/h10H,3-9H2,1-2H3,(H,12,13)
InChIKeyBUOFYUADIXMLHI-UHFFFAOYSA-N
MW182.31 g/mol
LogP2.74
Rot. Bonds6

About 2,5-dibutyl-4,5-dihydro-1H-imidazole

2,5-dibutyl-4,5-dihydro-1H-imidazole (PubChem CID 88688688) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 2,5-dibutyl-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2,5-dibutyl-4,5-dihydro-1H-imidazole
PubChem CID88688688
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name2,5-dibutyl-4,5-dihydro-1H-imidazole
SMILESCCCCC1=NCC(CCCC)N1
InChIInChI=1S/C11H22N2/c1-3-5-7-10-9-12-11(13-10)8-6-4-2/h10H,3-9H2,1-2H3,(H,12,13)
InChIKeyBUOFYUADIXMLHI-UHFFFAOYSA-N
XLogP2.74
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-dodecyl-4,5-dihydro-1H-imidazol-5-yl)pentan-1-ol
CID 70187734
2-(2-nonyl-4,5-dihydro-1H-imidazol-5-yl)ethanol
CID 123914747
2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol
CID 19376922
2-[5-[(Z)-octadec-9-enyl]-4,5-dihydro-1H-imidazol-2-yl]ethanol
CID 66623851
(E)-N-[(2-butyl-4,5-dihydro-1H-imidazol-5-yl)methyl]hex-3-en-3-amine
CID 167058425
2-non-8-enyl-5-prop-2-enyl-4,5-dihydro-1H-imidazole
CID 69133066
2-[5-(2-dodecylcyclohexyl)-4,5-dihydro-1H-imidazol-2-yl]ethanol
CID 70536806
(2R,5S)-2,5-dipentylpyrrolidine
CID 15831903
[(2S,5S)-5-butylpyrrolidin-2-yl]methanol
CID 131230214
(2S,6R)-2-butyl-6-hexylpiperidine
CID 139750067
(2R,6S)-2,6-dibutylpiperidin-4-one
CID 24773544
(2R,5R)-2,5-dipentylpyrrolidine;hydrochloride
CID 44889697

Frequently Asked Questions

What is the IUPAC name of 2,5-dibutyl-4,5-dihydro-1H-imidazole?
The IUPAC name of 2,5-dibutyl-4,5-dihydro-1H-imidazole (CID 88688688) is 2,5-dibutyl-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2,5-dibutyl-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2,5-dibutyl-4,5-dihydro-1H-imidazole is CCCCC1=NCC(CCCC)N1.
What is the InChIKey of 2,5-dibutyl-4,5-dihydro-1H-imidazole?
The InChIKey is BUOFYUADIXMLHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-3-5-7-10-9-12-11(13-10)8-6-4-2/h10H,3-9H2,1-2H3,(H,12,13).
What are the key properties of 2,5-dibutyl-4,5-dihydro-1H-imidazole?
2,5-dibutyl-4,5-dihydro-1H-imidazole has a molecular weight of 182.31 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dibutyl-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 88688688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).