N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine

C13H25N3 — CID 79761292

IUPACN-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine
SMILESCCCCC(Cc1nccn1CC)NCC
InChIInChI=1S/C13H25N3/c1-4-7-8-12(14-5-2)11-13-15-9-10-16(13)6-3/h9-10,12,14H,4-8,11H2,1-3H3
InChIKeyPYZPBPKZIFLCIU-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.61
Rot. Bonds8

About N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine

N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine (PubChem CID 79761292) has the molecular formula C13H25N3 and a molecular weight of 223.36 g/mol. Its IUPAC name is N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine
PubChem CID79761292
Molecular FormulaC13H25N3
Molecular Weight223.36 g/mol
Exact Mass223.20
IUPAC NameN-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine
SMILESCCCCC(Cc1nccn1CC)NCC
InChIInChI=1S/C13H25N3/c1-4-7-8-12(14-5-2)11-13-15-9-10-16(13)6-3/h9-10,12,14H,4-8,11H2,1-3H3
InChIKeyPYZPBPKZIFLCIU-UHFFFAOYSA-N
XLogP2.61
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-ethylimidazol-2-yl)-N-propylnonan-2-amine
CID 105009255
N-ethyl-1-(1-ethylimidazol-2-yl)-5-phenylpentan-2-amine
CID 105165971
N-ethyl-1-(1-ethylimidazol-2-yl)-4-methoxybutan-2-amine
CID 79751583
1-N,1-N,3-N-triethyl-4-(1-ethylimidazol-2-yl)butane-1,3-diamine
CID 79762134
N-ethyl-1-(1-ethylimidazol-2-yl)-4-phenoxybutan-2-amine
CID 79751315
N-propyl-1-(1-propylimidazol-2-yl)heptan-2-amine
CID 105012472
N-ethyl-1-(1-ethylimidazol-2-yl)-3-(4-fluorophenyl)propan-2-amine
CID 79752901
N-ethyl-1-(1-ethylimidazol-2-yl)-3-(2,2,2-trifluoroethoxy)propan-2-amine
CID 103215787
N-ethyl-4-propoxy-1-(1-propylimidazol-2-yl)butan-2-amine
CID 105167661
1-N,1-N-diethyl-4-(1-ethylimidazol-2-yl)-3-N-propylbutane-1,3-diamine
CID 79760507
N-ethyl-1-(1-ethylimidazol-2-yl)-3-phenoxypropan-2-amine
CID 79751835
1-(1-ethylimidazol-2-yl)undecan-2-amine
CID 105009322

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine?
The IUPAC name of N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine (CID 79761292) is N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine.
What is the SMILES notation for N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine?
The canonical SMILES for N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine is CCCCC(Cc1nccn1CC)NCC.
What is the InChIKey of N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine?
The InChIKey is PYZPBPKZIFLCIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3/c1-4-7-8-12(14-5-2)11-13-15-9-10-16(13)6-3/h9-10,12,14H,4-8,11H2,1-3H3.
What are the key properties of N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine?
N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine has a molecular weight of 223.36 g/mol, XLogP of 2.61, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(1-ethylimidazol-2-yl)hexan-2-amine is sourced from PubChem (CID 79761292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).