2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole

C12H16N2 — CID 58951819

IUPAC2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole
SMILESCc1ccc(C)c(CC2=NCCN2)c1
InChIInChI=1S/C12H16N2/c1-9-3-4-10(2)11(7-9)8-12-13-5-6-14-12/h3-4,7H,5-6,8H2,1-2H3,(H,13,14)
InChIKeyGINRZYACXRCJPN-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.85
Rot. Bonds2

About 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole

2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole (PubChem CID 58951819) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole
PubChem CID58951819
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole
SMILESCc1ccc(C)c(CC2=NCCN2)c1
InChIInChI=1S/C12H16N2/c1-9-3-4-10(2)11(7-9)8-12-13-5-6-14-12/h3-4,7H,5-6,8H2,1-2H3,(H,13,14)
InChIKeyGINRZYACXRCJPN-UHFFFAOYSA-N
XLogP1.85
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(5-fluoro-2-methylphenyl)methyl]-4,5-dihydro-1H-imidazole
CID 58951723
4-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2,5-dimethylphenol
CID 58951794
2-[(6-methyl-9,10-dihydroanthracen-2-yl)methyl]-4,5-dihydro-1H-imidazole
CID 59637378
N-[3-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2,5-dimethylphenyl]methanesulfonamide;hydrochloride
CID 18789676
2-[2-(2-(111C)methylphenyl)ethyl]-4,5-dihydro-1H-imidazole
CID 56935582
1,3-bis[(2,5-dimethylphenyl)methyl]-2,5-dimethylbenzene
CID 20734489
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3,4-dimethyl-N-phenylaniline
CID 145214361
4-N-[(2,5-dimethylphenyl)methyl]-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122756
2-benzyl-4,5-dihydro-1H-imidazole;hydrate
CID 174926458
1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4,7-dimethyl-2,3-dihydroindole
CID 76850743
2-[[2-ethyl-4-(fluoromethylsulfonyl)phenyl]methyl]-4,5-dihydro-1H-imidazole
CID 170150893
3-[N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4-methylanilino]phenol chloride
CID 19386760

Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole (CID 58951819) is 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole is Cc1ccc(C)c(CC2=NCCN2)c1.
What is the InChIKey of 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole?
The InChIKey is GINRZYACXRCJPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-9-3-4-10(2)11(7-9)8-12-13-5-6-14-12/h3-4,7H,5-6,8H2,1-2H3,(H,13,14).
What are the key properties of 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole?
2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole has a molecular weight of 188.27 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 58951819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).