1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine

C15H20Cl2N4 — CID 10853628

IUPAC1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
SMILESCN1CCN(Cc2c(Cl)cccc2Cl)C(C2=NCCN2)C1
InChIInChI=1S/C15H20Cl2N4/c1-20-7-8-21(14(10-20)15-18-5-6-19-15)9-11-12(16)3-2-4-13(11)17/h2-4,14H,5-10H2,1H3,(H,18,19)
InChIKeyFIASRUZAYZVVQO-UHFFFAOYSA-N
MW327.26 g/mol
LogP2.11
Rot. Bonds3

About 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine

1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine (PubChem CID 10853628) has the molecular formula C15H20Cl2N4 and a molecular weight of 327.26 g/mol. Its IUPAC name is 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine.

Molecular Properties

Compound Name1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
PubChem CID10853628
Molecular FormulaC15H20Cl2N4
Molecular Weight327.26 g/mol
Exact Mass326.11
IUPAC Name1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
SMILESCN1CCN(Cc2c(Cl)cccc2Cl)C(C2=NCCN2)C1
InChIInChI=1S/C15H20Cl2N4/c1-20-7-8-21(14(10-20)15-18-5-6-19-15)9-11-12(16)3-2-4-13(11)17/h2-4,14H,5-10H2,1H3,(H,18,19)
InChIKeyFIASRUZAYZVVQO-UHFFFAOYSA-N
XLogP2.11
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.26
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

St 1913
CID 123528
5-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 44371599
(4R,5S)-2-[2-(2-chlorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388794
2-(2,4-Dichlorophenyl)-4,5-dihydro-1H-imidazole
CID 12341497
5-chloro-2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1-methyl-3,4-dihydro-1H-isoquinoline;dihydrochloride
CID 73346595
5-chloro-2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3,4-dihydro-1H-isoquinoline;dihydrochloride
CID 73346596
8-chloro-2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3,4-dihydro-1H-isoquinoline;dihydrochloride
CID 73348090
1-[(2,4-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
CID 9797434
2-(2-chlorophenyl)-4,5-dihydro-1H-imidazole
CID 3753467
(4R,5S)-2-[(2-chlorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44389006
1-[(2-chlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
CID 9994508
4-[(2-chlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-1-ethylpiperazine
CID 10494914

Frequently Asked Questions

What is the IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine?
The IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine (CID 10853628) is 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine.
What is the SMILES notation for 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine?
The canonical SMILES for 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine is CN1CCN(Cc2c(Cl)cccc2Cl)C(C2=NCCN2)C1.
What is the InChIKey of 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine?
The InChIKey is FIASRUZAYZVVQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N4/c1-20-7-8-21(14(10-20)15-18-5-6-19-15)9-11-12(16)3-2-4-13(11)17/h2-4,14H,5-10H2,1H3,(H,18,19).
What are the key properties of 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine?
1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine has a molecular weight of 327.26 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,6-dichlorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine is sourced from PubChem (CID 10853628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).