1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine

C12H26N4 — CID 79496710

IUPAC1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine
SMILESCCCC(C)C1CN=C(N)N1CCN(C)C
InChIInChI=1S/C12H26N4/c1-5-6-10(2)11-9-14-12(13)16(11)8-7-15(3)4/h10-11H,5-9H2,1-4H3,(H2,13,14)
InChIKeyZWBZWEAQPPUPIN-UHFFFAOYSA-N
MW226.37 g/mol
LogP0.98
Rot. Bonds6

About 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine

1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine (PubChem CID 79496710) has the molecular formula C12H26N4 and a molecular weight of 226.37 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine
PubChem CID79496710
Molecular FormulaC12H26N4
Molecular Weight226.37 g/mol
Exact Mass226.22
IUPAC Name1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine
SMILESCCCC(C)C1CN=C(N)N1CCN(C)C
InChIInChI=1S/C12H26N4/c1-5-6-10(2)11-9-14-12(13)16(11)8-7-15(3)4/h10-11H,5-9H2,1-4H3,(H2,13,14)
InChIKeyZWBZWEAQPPUPIN-UHFFFAOYSA-N
XLogP0.98
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.37
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine (CID 79496710) is 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine is CCCC(C)C1CN=C(N)N1CCN(C)C.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine?
The InChIKey is ZWBZWEAQPPUPIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4/c1-5-6-10(2)11-9-14-12(13)16(11)8-7-15(3)4/h10-11H,5-9H2,1-4H3,(H2,13,14).
What are the key properties of 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine?
1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine has a molecular weight of 226.37 g/mol, XLogP of 0.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-5-pentan-2-yl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79496710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).