5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine

C15H22Cl2N4 — CID 79501221

IUPAC5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine
SMILESCCN(CC)CCN1C(N)=NCC1c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H22Cl2N4/c1-3-20(4-2)5-6-21-14(10-19-15(21)18)11-7-12(16)9-13(17)8-11/h7-9,14H,3-6,10H2,1-2H3,(H2,18,19)
InChIKeyIOJGBUQPUHWFTN-UHFFFAOYSA-N
MW329.28 g/mol
LogP3.01
Rot. Bonds6

About 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine

5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine (PubChem CID 79501221) has the molecular formula C15H22Cl2N4 and a molecular weight of 329.28 g/mol. Its IUPAC name is 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine
PubChem CID79501221
Molecular FormulaC15H22Cl2N4
Molecular Weight329.28 g/mol
Exact Mass328.12
IUPAC Name5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine
SMILESCCN(CC)CCN1C(N)=NCC1c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H22Cl2N4/c1-3-20(4-2)5-6-21-14(10-19-15(21)18)11-7-12(16)9-13(17)8-11/h7-9,14H,3-6,10H2,1-2H3,(H2,18,19)
InChIKeyIOJGBUQPUHWFTN-UHFFFAOYSA-N
XLogP3.01
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.28
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine (CID 79501221) is 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine is CCN(CC)CCN1C(N)=NCC1c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The InChIKey is IOJGBUQPUHWFTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Cl2N4/c1-3-20(4-2)5-6-21-14(10-19-15(21)18)11-7-12(16)9-13(17)8-11/h7-9,14H,3-6,10H2,1-2H3,(H2,18,19).
What are the key properties of 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine has a molecular weight of 329.28 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dichlorophenyl)-1-[2-(diethylamino)ethyl]-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79501221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).