ethane;2-ethyl-4-methyl-1-propylimidazole

C11H22N2 — CID 156794089

IUPACethane;2-ethyl-4-methyl-1-propylimidazole
SMILESCC.CCCn1cc(C)nc1CC
InChIInChI=1S/C9H16N2.C2H6/c1-4-6-11-7-8(3)10-9(11)5-2;1-2/h7H,4-6H2,1-3H3;1-2H3
InChIKeyDRDIVVFICMVOGH-UHFFFAOYSA-N
MW182.31 g/mol
LogP3.19
Rot. Bonds3

About ethane;2-ethyl-4-methyl-1-propylimidazole

ethane;2-ethyl-4-methyl-1-propylimidazole (PubChem CID 156794089) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is ethane;2-ethyl-4-methyl-1-propylimidazole.

Molecular Properties

Compound Nameethane;2-ethyl-4-methyl-1-propylimidazole
PubChem CID156794089
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Nameethane;2-ethyl-4-methyl-1-propylimidazole
SMILESCC.CCCn1cc(C)nc1CC
InChIInChI=1S/C9H16N2.C2H6/c1-4-6-11-7-8(3)10-9(11)5-2;1-2/h7H,4-6H2,1-3H3;1-2H3
InChIKeyDRDIVVFICMVOGH-UHFFFAOYSA-N
XLogP3.19
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-ethyl-4-methylimidazol-1-yl)methanamine
CID 141279094
2-ethyl-1-(2-isocyanoethyl)-4-methylimidazole
CID 168830546
2-(2-ethyl-4-methylimidazol-1-yl)acetaldehyde
CID 89011423
2-ethyl-4-methyl-1-prop-2-enylimidazole
CID 19066610
3-(2-ethyl-4-methylimidazol-1-yl)propanimidamide
CID 42614727
2-ethyl-4-methylimidazol-1-amine
CID 154091770
1-[3-(2-ethyl-4-methylimidazol-1-yl)propoxy]butan-2-ol
CID 126645258
6-[2-(2-ethyl-4-methylimidazol-1-yl)ethyl]-2,4-dihydro-1,3,5-triazine-1,3-diamine
CID 67940125
(1-ethyl-4-methylimidazol-2-yl)methanol
CID 117187857
1-butyl-2,4-dimethylimidazole
CID 69009415
2-ethyl-4-(3-phenylpropyl)-1-propylimidazole
CID 69395494
3-(4-methyl-2-undecylimidazol-1-yl)propanenitrile
CID 170847829

Frequently Asked Questions

What is the IUPAC name of ethane;2-ethyl-4-methyl-1-propylimidazole?
The IUPAC name of ethane;2-ethyl-4-methyl-1-propylimidazole (CID 156794089) is ethane;2-ethyl-4-methyl-1-propylimidazole.
What is the SMILES notation for ethane;2-ethyl-4-methyl-1-propylimidazole?
The canonical SMILES for ethane;2-ethyl-4-methyl-1-propylimidazole is CC.CCCn1cc(C)nc1CC.
What is the InChIKey of ethane;2-ethyl-4-methyl-1-propylimidazole?
The InChIKey is DRDIVVFICMVOGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2.C2H6/c1-4-6-11-7-8(3)10-9(11)5-2;1-2/h7H,4-6H2,1-3H3;1-2H3.
What are the key properties of ethane;2-ethyl-4-methyl-1-propylimidazole?
ethane;2-ethyl-4-methyl-1-propylimidazole has a molecular weight of 182.31 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethyl-4-methyl-1-propylimidazole is sourced from PubChem (CID 156794089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).