(5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine

C12H17N3 — CID 24856300

IUPAC(5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine
SMILESCCN1C(Nc2ccccc2)=NC[C@@H]1C
InChIInChI=1S/C12H17N3/c1-3-15-10(2)9-13-12(15)14-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,13,14)/t10-/m0/s1
InChIKeyHTHFUPBVLMVNNQ-JTQLQIEISA-N
MW203.29 g/mol
LogP2.18
Rot. Bonds2

About (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine

(5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine (PubChem CID 24856300) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name(5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine
PubChem CID24856300
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name(5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine
SMILESCCN1C(Nc2ccccc2)=NC[C@@H]1C
InChIInChI=1S/C12H17N3/c1-3-15-10(2)9-13-12(15)14-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,13,14)/t10-/m0/s1
InChIKeyHTHFUPBVLMVNNQ-JTQLQIEISA-N
XLogP2.18
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine (CID 24856300) is (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine is CCN1C(Nc2ccccc2)=NC[C@@H]1C.
What is the InChIKey of (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine?
The InChIKey is HTHFUPBVLMVNNQ-JTQLQIEISA-N. The full InChI is InChI=1S/C12H17N3/c1-3-15-10(2)9-13-12(15)14-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,13,14)/t10-/m0/s1.
What are the key properties of (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine?
(5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine has a molecular weight of 203.29 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-1-ethyl-5-methyl-N-phenyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 24856300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).