N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride

C20H19Cl2N3 — CID 3028783

IUPACN-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride
SMILESCN1C(Nc2ccccc2Cl)=NCC1c1cccc2ccccc12.Cl
InChIInChI=1S/C20H18ClN3.ClH/c1-24-19(16-10-6-8-14-7-2-3-9-15(14)16)13-22-20(24)23-18-12-5-4-11-17(18)21;/h2-12,19H,13H2,1H3,(H,22,23);1H
InChIKeyVEBKFGGONLRWHT-UHFFFAOYSA-N
MW372.30 g/mol
LogP5.37
Rot. Bonds2

About N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride

N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride (PubChem CID 3028783) has the molecular formula C20H19Cl2N3 and a molecular weight of 372.30 g/mol. Its IUPAC name is N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride.

Molecular Properties

Compound NameN-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride
PubChem CID3028783
Molecular FormulaC20H19Cl2N3
Molecular Weight372.30 g/mol
Exact Mass371.10
IUPAC NameN-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride
SMILESCN1C(Nc2ccccc2Cl)=NCC1c1cccc2ccccc12.Cl
InChIInChI=1S/C20H18ClN3.ClH/c1-24-19(16-10-6-8-14-7-2-3-9-15(14)16)13-22-20(24)23-18-12-5-4-11-17(18)21;/h2-12,19H,13H2,1H3,(H,22,23);1H
InChIKeyVEBKFGGONLRWHT-UHFFFAOYSA-N
XLogP5.37
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.30
LogP ≤ 55.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride?
The IUPAC name of N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride (CID 3028783) is N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride.
What is the SMILES notation for N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride?
The canonical SMILES for N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride is CN1C(Nc2ccccc2Cl)=NCC1c1cccc2ccccc12.Cl.
What is the InChIKey of N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride?
The InChIKey is VEBKFGGONLRWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3.ClH/c1-24-19(16-10-6-8-14-7-2-3-9-15(14)16)13-22-20(24)23-18-12-5-4-11-17(18)21;/h2-12,19H,13H2,1H3,(H,22,23);1H.
What are the key properties of N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride?
N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride has a molecular weight of 372.30 g/mol, XLogP of 5.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-1-methyl-5-naphthalen-1-yl-4,5-dihydroimidazol-2-amine;hydrochloride is sourced from PubChem (CID 3028783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).