N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine

C17H19N3 — CID 154179390

IUPACN-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1cccc(N2CCN=C2NCc2ccccc2)c1
InChIInChI=1S/C17H19N3/c1-14-6-5-9-16(12-14)20-11-10-18-17(20)19-13-15-7-3-2-4-8-15/h2-9,12H,10-11,13H2,1H3,(H,18,19)
InChIKeyWXMOOXNGMJKUEO-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.96
Rot. Bonds3

About N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine

N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 154179390) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID154179390
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1cccc(N2CCN=C2NCc2ccccc2)c1
InChIInChI=1S/C17H19N3/c1-14-6-5-9-16(12-14)20-11-10-18-17(20)19-13-15-7-3-2-4-8-15/h2-9,12H,10-11,13H2,1H3,(H,18,19)
InChIKeyWXMOOXNGMJKUEO-UHFFFAOYSA-N
XLogP2.96
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluorophenyl)-2-[2-(3-methylphenyl)ethyl]-4,5-dihydroimidazole
CID 154367030
1-[3-[[(1-methyl-4,5-dihydroimidazol-2-yl)amino]methyl]phenyl]pyrrolidin-2-one
CID 120970003
[5-(benzylamino)pyrazin-2-yl]-[4-(3-methylphenyl)piperazin-1-yl]methanone
CID 109279832
1-methyl-N-[(4-phenylmethoxyphenyl)methyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969601
[2-[(3-methylphenyl)methylamino]pyrimidin-5-yl]-(4-phenylpiperazin-1-yl)methanone
CID 109255963
1-[3-[(3-methylphenyl)methylamino]phenyl]imidazolidin-2-one
CID 43696493
1-benzyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydroiodide
CID 166367101
N-benzyl-2-[4-(3-methylphenyl)piperazin-1-yl]pyrimidine-5-carboxamide
CID 109255251
1-(3-methylphenyl)-N-[(1-phenylpyrazol-4-yl)methyl]methanamine
CID 28663771
1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide
CID 166193259
1,3-bis(3-methylphenyl)-2H-imidazo[4,5-b]pyrazine
CID 140706711
N-benzyl-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 109018781

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine (CID 154179390) is N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine is Cc1cccc(N2CCN=C2NCc2ccccc2)c1.
What is the InChIKey of N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is WXMOOXNGMJKUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-14-6-5-9-16(12-14)20-11-10-18-17(20)19-13-15-7-3-2-4-8-15/h2-9,12H,10-11,13H2,1H3,(H,18,19).
What are the key properties of N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 265.36 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 154179390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).