1,4-dipropylimidazole;ethane

C11H22N2 — CID 165398933

IUPAC1,4-dipropylimidazole;ethane
SMILESCC.CCCc1cn(CCC)cn1
InChIInChI=1S/C9H16N2.C2H6/c1-3-5-9-7-11(6-4-2)8-10-9;1-2/h7-8H,3-6H2,1-2H3;1-2H3
InChIKeyHOIDMJMNBZGFEE-UHFFFAOYSA-N
MW182.31 g/mol
LogP3.27
Rot. Bonds4

About 1,4-dipropylimidazole;ethane

1,4-dipropylimidazole;ethane (PubChem CID 165398933) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1,4-dipropylimidazole;ethane.

Molecular Properties

Compound Name1,4-dipropylimidazole;ethane
PubChem CID165398933
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1,4-dipropylimidazole;ethane
SMILESCC.CCCc1cn(CCC)cn1
InChIInChI=1S/C9H16N2.C2H6/c1-3-5-9-7-11(6-4-2)8-10-9;1-2/h7-8H,3-6H2,1-2H3;1-2H3
InChIKeyHOIDMJMNBZGFEE-UHFFFAOYSA-N
XLogP3.27
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-4-propylimidazole
CID 20703275
ethane;4-ethyl-1-pentylimidazole
CID 142090904
2-(4-hexadecylimidazol-1-yl)ethanol
CID 175193401
4-butyl-1-(3-methylbutyl)imidazole
CID 164535740
(1-butylimidazol-4-yl)methanamine
CID 82467842
(1-pentylimidazol-4-yl)methanol
CID 11147952
4-propan-2-yl-1-propylimidazole
CID 58213384
N-ethyl-2-[1-(2-ethylsulfonylethyl)imidazol-4-yl]ethanamine
CID 106729436
N-[[1-(2-aminoethyl)imidazol-4-yl]methyl]-N-propylpropan-1-amine
CID 107500626
ethane;1-methyl-4-propyltriazole
CID 168923376
2-(1-ethylimidazol-4-yl)ethanamine;dihydrochloride
CID 122129869
4-ethenyl-1-propylimidazole
CID 118166660

Frequently Asked Questions

What is the IUPAC name of 1,4-dipropylimidazole;ethane?
The IUPAC name of 1,4-dipropylimidazole;ethane (CID 165398933) is 1,4-dipropylimidazole;ethane.
What is the SMILES notation for 1,4-dipropylimidazole;ethane?
The canonical SMILES for 1,4-dipropylimidazole;ethane is CC.CCCc1cn(CCC)cn1.
What is the InChIKey of 1,4-dipropylimidazole;ethane?
The InChIKey is HOIDMJMNBZGFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2.C2H6/c1-3-5-9-7-11(6-4-2)8-10-9;1-2/h7-8H,3-6H2,1-2H3;1-2H3.
What are the key properties of 1,4-dipropylimidazole;ethane?
1,4-dipropylimidazole;ethane has a molecular weight of 182.31 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dipropylimidazole;ethane is sourced from PubChem (CID 165398933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).