N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine

C12H17N3 — CID 10354248

IUPACN-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1cc(C)c(NC2=NCCN2)c(C)c1
InChIInChI=1S/C12H17N3/c1-8-6-9(2)11(10(3)7-8)15-12-13-4-5-14-12/h6-7H,4-5H2,1-3H3,(H2,13,14,15)
InChIKeyVQYZRHIHKJYMPA-UHFFFAOYSA-N
MW203.29 g/mol
LogP1.98
Rot. Bonds1

About N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine

N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 10354248) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID10354248
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC NameN-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1cc(C)c(NC2=NCCN2)c(C)c1
InChIInChI=1S/C12H17N3/c1-8-6-9(2)11(10(3)7-8)15-12-13-4-5-14-12/h6-7H,4-5H2,1-3H3,(H2,13,14,15)
InChIKeyVQYZRHIHKJYMPA-UHFFFAOYSA-N
XLogP1.98
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine (CID 10354248) is N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine is Cc1cc(C)c(NC2=NCCN2)c(C)c1.
What is the InChIKey of N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is VQYZRHIHKJYMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-8-6-9(2)11(10(3)7-8)15-12-13-4-5-14-12/h6-7H,4-5H2,1-3H3,(H2,13,14,15).
What are the key properties of N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 203.29 g/mol, XLogP of 1.98, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 10354248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).