1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine

C15H30N4 — CID 79056002

IUPAC1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine
SMILESCCNC(c1nccn1CC)C(C)(C)N(CC)CC
InChIInChI=1S/C15H30N4/c1-7-16-13(14-17-11-12-18(14)8-2)15(5,6)19(9-3)10-4/h11-13,16H,7-10H2,1-6H3
InChIKeyCCYOAZDGGLIUIO-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.67
Rot. Bonds8

About 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine

1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine (PubChem CID 79056002) has the molecular formula C15H30N4 and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine
PubChem CID79056002
Molecular FormulaC15H30N4
Molecular Weight266.43 g/mol
Exact Mass266.25
IUPAC Name1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine
SMILESCCNC(c1nccn1CC)C(C)(C)N(CC)CC
InChIInChI=1S/C15H30N4/c1-7-16-13(14-17-11-12-18(14)8-2)15(5,6)19(9-3)10-4/h11-13,16H,7-10H2,1-6H3
InChIKeyCCYOAZDGGLIUIO-UHFFFAOYSA-N
XLogP2.67
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine
CID 79055749
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CID 64768372
N-ethyl-1-(1-ethylimidazol-2-yl)-2-methylpropan-1-amine
CID 63967917
2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79053769
N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine
CID 64721202
2-ethoxy-N-ethyl-1-(1-ethylimidazol-2-yl)propan-1-amine
CID 64533396
N-ethyl-1-(1-ethylimidazol-2-yl)-4-methylpentan-1-amine
CID 63967928
2-(1-bromoethyl)-1-ethylimidazole
CID 71635251
2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol
CID 79063348
N-ethyl-1-(1-ethylimidazol-2-yl)-3,3-dimethylbutan-2-amine
CID 63198335
N-ethyl-2-methyl-2-morpholin-4-yl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 79051327
4-[ethylamino-(1-ethylimidazol-2-yl)methyl]-N,N-dimethylaniline
CID 105149884

Frequently Asked Questions

What is the IUPAC name of 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine?
The IUPAC name of 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine (CID 79056002) is 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine.
What is the SMILES notation for 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine?
The canonical SMILES for 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine is CCNC(c1nccn1CC)C(C)(C)N(CC)CC.
What is the InChIKey of 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine?
The InChIKey is CCYOAZDGGLIUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4/c1-7-16-13(14-17-11-12-18(14)8-2)15(5,6)19(9-3)10-4/h11-13,16H,7-10H2,1-6H3.
What are the key properties of 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine?
1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine has a molecular weight of 266.43 g/mol, XLogP of 2.67, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine is sourced from PubChem (CID 79056002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).