(4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene

C24H38N2O — CID 143001469

IUPAC(4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene
SMILESC/C=C\C=C/CC.CC.CC1NC(COC2CCC2)=N[C@@H]1c1ccccc1
InChIInChI=1S/C15H20N2O.C7H12.C2H6/c1-11-15(12-6-3-2-4-7-12)17-14(16-11)10-18-13-8-5-9-13;1-3-5-7-6-4-2;1-2/h2-4,6-7,11,13,15H,5,8-10H2,1H3,(H,16,17);3,5-7H,4H2,1-2H3;1-2H3/b;5-3-,7-6-;/t11?,15-;;/m0../s1
InChIKeyQTCWVMGKKZGZHE-OGJMKKIHSA-N
MW370.58 g/mol
LogP6.24
Rot. Bonds6

About (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene

(4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene (PubChem CID 143001469) has the molecular formula C24H38N2O and a molecular weight of 370.58 g/mol. Its IUPAC name is (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene.

Molecular Properties

Compound Name(4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene
PubChem CID143001469
Molecular FormulaC24H38N2O
Molecular Weight370.58 g/mol
Exact Mass370.30
IUPAC Name(4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene
SMILESC/C=C\C=C/CC.CC.CC1NC(COC2CCC2)=N[C@@H]1c1ccccc1
InChIInChI=1S/C15H20N2O.C7H12.C2H6/c1-11-15(12-6-3-2-4-7-12)17-14(16-11)10-18-13-8-5-9-13;1-3-5-7-6-4-2;1-2/h2-4,6-7,11,13,15H,5,8-10H2,1H3,(H,16,17);3,5-7H,4H2,1-2H3;1-2H3/b;5-3-,7-6-;/t11?,15-;;/m0../s1
InChIKeyQTCWVMGKKZGZHE-OGJMKKIHSA-N
XLogP6.24
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.58
LogP ≤ 56.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene 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 (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene?
The IUPAC name of (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene (CID 143001469) is (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene.
What is the SMILES notation for (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene?
The canonical SMILES for (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene is C/C=C\C=C/CC.CC.CC1NC(COC2CCC2)=N[C@@H]1c1ccccc1.
What is the InChIKey of (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene?
The InChIKey is QTCWVMGKKZGZHE-OGJMKKIHSA-N. The full InChI is InChI=1S/C15H20N2O.C7H12.C2H6/c1-11-15(12-6-3-2-4-7-12)17-14(16-11)10-18-13-8-5-9-13;1-3-5-7-6-4-2;1-2/h2-4,6-7,11,13,15H,5,8-10H2,1H3,(H,16,17);3,5-7H,4H2,1-2H3;1-2H3/b;5-3-,7-6-;/t11?,15-;;/m0../s1.
What are the key properties of (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene?
(4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene has a molecular weight of 370.58 g/mol, XLogP of 6.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-(cyclobutyloxymethyl)-5-methyl-4-phenyl-4,5-dihydro-1H-imidazole;ethane;(2Z,4Z)-hepta-2,4-diene is sourced from PubChem (CID 143001469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).