N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine

C12H23N3 — CID 64721202

IUPACN-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine
SMILESCCNC(C)CC(C)c1nccn1CC
InChIInChI=1S/C12H23N3/c1-5-13-11(4)9-10(3)12-14-7-8-15(12)6-2/h7-8,10-11,13H,5-6,9H2,1-4H3
InChIKeyQFCLOFTXIAJSEH-UHFFFAOYSA-N
MW209.34 g/mol
LogP2.39
Rot. Bonds6

About N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine

N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine (PubChem CID 64721202) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine
PubChem CID64721202
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC NameN-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine
SMILESCCNC(C)CC(C)c1nccn1CC
InChIInChI=1S/C12H23N3/c1-5-13-11(4)9-10(3)12-14-7-8-15(12)6-2/h7-8,10-11,13H,5-6,9H2,1-4H3
InChIKeyQFCLOFTXIAJSEH-UHFFFAOYSA-N
XLogP2.39
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(1-ethylimidazol-2-yl)-2-methylpropan-1-amine
CID 63967917
N-ethyl-1-(1-ethylimidazol-2-yl)-4-methylpentan-1-amine
CID 63967928
2-ethoxy-N-ethyl-1-(1-ethylimidazol-2-yl)propan-1-amine
CID 64533396
1-(1-ethylimidazol-2-yl)ethanamine
CID 63970415
1-ethyl-2-[(1R)-1-iodoethyl]imidazole
CID 97177373
2-(1-bromoethyl)-1-ethylimidazole
CID 71635251
3-(1-ethylimidazol-2-yl)-N-methylbutan-2-amine
CID 63199792
1-(1-ethylimidazol-2-yl)-N,2-dimethylpropan-1-amine
CID 63967915
N-ethyl-1-(1-ethylimidazol-2-yl)-2-methylsulfonylethanamine
CID 115622275
3-ethoxy-N-ethyl-1-(1-ethylimidazol-2-yl)propan-1-amine
CID 105149887
[1-(1-ethylimidazol-2-yl)-3-methylbutyl]hydrazine
CID 105198831
N-[(1-ethylimidazol-2-yl)-(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine
CID 65199087

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine?
The IUPAC name of N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine (CID 64721202) is N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine.
What is the SMILES notation for N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine?
The canonical SMILES for N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine is CCNC(C)CC(C)c1nccn1CC.
What is the InChIKey of N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine?
The InChIKey is QFCLOFTXIAJSEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-5-13-11(4)9-10(3)12-14-7-8-15(12)6-2/h7-8,10-11,13H,5-6,9H2,1-4H3.
What are the key properties of N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine?
N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine has a molecular weight of 209.34 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(1-ethylimidazol-2-yl)pentan-2-amine is sourced from PubChem (CID 64721202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).