N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine

C19H23N3 — CID 24856264

IUPACN-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine
SMILESCC(CCN1CCN=C1Nc1ccccc1)c1ccccc1
InChIInChI=1S/C19H23N3/c1-16(17-8-4-2-5-9-17)12-14-22-15-13-20-19(22)21-18-10-6-3-7-11-18/h2-11,16H,12-15H2,1H3,(H,20,21)
InChIKeyNTJMXHLQXCIYGX-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.96
Rot. Bonds5

About N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine

N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine (PubChem CID 24856264) has the molecular formula C19H23N3 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine
PubChem CID24856264
Molecular FormulaC19H23N3
Molecular Weight293.41 g/mol
Exact Mass293.19
IUPAC NameN-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine
SMILESCC(CCN1CCN=C1Nc1ccccc1)c1ccccc1
InChIInChI=1S/C19H23N3/c1-16(17-8-4-2-5-9-17)12-14-22-15-13-20-19(22)21-18-10-6-3-7-11-18/h2-11,16H,12-15H2,1H3,(H,20,21)
InChIKeyNTJMXHLQXCIYGX-UHFFFAOYSA-N
XLogP3.96
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine (CID 24856264) is N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine is CC(CCN1CCN=C1Nc1ccccc1)c1ccccc1.
What is the InChIKey of N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is NTJMXHLQXCIYGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3/c1-16(17-8-4-2-5-9-17)12-14-22-15-13-20-19(22)21-18-10-6-3-7-11-18/h2-11,16H,12-15H2,1H3,(H,20,21).
What are the key properties of N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine?
N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 293.41 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1-(3-phenylbutyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 24856264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).