2-butyl-1-ethylimidazole;hydrochloride

C9H17ClN2 — CID 173083631

IUPAC2-butyl-1-ethylimidazole;hydrochloride
SMILESCCCCc1nccn1CC.Cl
InChIInChI=1S/C9H16N2.ClH/c1-3-5-6-9-10-7-8-11(9)4-2;/h7-8H,3-6H2,1-2H3;1H
InChIKeyZOBFNPXVDJWCLR-UHFFFAOYSA-N
MW188.70 g/mol
LogP2.67
Rot. Bonds4

About 2-butyl-1-ethylimidazole;hydrochloride

2-butyl-1-ethylimidazole;hydrochloride (PubChem CID 173083631) has the molecular formula C9H17ClN2 and a molecular weight of 188.70 g/mol. Its IUPAC name is 2-butyl-1-ethylimidazole;hydrochloride.

Molecular Properties

Compound Name2-butyl-1-ethylimidazole;hydrochloride
PubChem CID173083631
Molecular FormulaC9H17ClN2
Molecular Weight188.70 g/mol
Exact Mass188.11
IUPAC Name2-butyl-1-ethylimidazole;hydrochloride
SMILESCCCCc1nccn1CC.Cl
InChIInChI=1S/C9H16N2.ClH/c1-3-5-6-9-10-7-8-11(9)4-2;/h7-8H,3-6H2,1-2H3;1H
InChIKeyZOBFNPXVDJWCLR-UHFFFAOYSA-N
XLogP2.67
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.70
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-butylimidazol-1-yl)methanol
CID 22012500
3-(1-ethylimidazol-2-yl)-N-[3-(1-ethylimidazol-2-yl)propyl]-N-methylpropan-1-amine
CID 140833519
2-dodecyl-1-ethylimidazole;trifluoromethanesulfonic acid
CID 173328420
1,2-di(pentadecyl)imidazole
CID 69388452
(2-hexylimidazol-1-yl)methanamine
CID 141279127
1-ethyl-2-(2-methoxyethyl)imidazole
CID 175783525
3-butyl-5-[(1-ethylimidazol-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine
CID 71995483
alumane;2-hexyl-1-methylimidazole;tetrahydrochloride
CID 174887731
3-(1-butylimidazol-2-yl)-N,N-bis[3-(1-butylimidazol-2-yl)propyl]propan-1-amine
CID 140833527
1-ethyl-2-(iodomethyl)imidazole
CID 64786618
2-butyl-1-(3-propan-2-yloxypropyl)imidazole
CID 57089790
2-(3-bromobutyl)-1-ethylimidazole
CID 64509820

Frequently Asked Questions

What is the IUPAC name of 2-butyl-1-ethylimidazole;hydrochloride?
The IUPAC name of 2-butyl-1-ethylimidazole;hydrochloride (CID 173083631) is 2-butyl-1-ethylimidazole;hydrochloride.
What is the SMILES notation for 2-butyl-1-ethylimidazole;hydrochloride?
The canonical SMILES for 2-butyl-1-ethylimidazole;hydrochloride is CCCCc1nccn1CC.Cl.
What is the InChIKey of 2-butyl-1-ethylimidazole;hydrochloride?
The InChIKey is ZOBFNPXVDJWCLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2.ClH/c1-3-5-6-9-10-7-8-11(9)4-2;/h7-8H,3-6H2,1-2H3;1H.
What are the key properties of 2-butyl-1-ethylimidazole;hydrochloride?
2-butyl-1-ethylimidazole;hydrochloride has a molecular weight of 188.70 g/mol, XLogP of 2.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-1-ethylimidazole;hydrochloride is sourced from PubChem (CID 173083631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).