bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole

C20H23N5 — CID 175419322

IUPACbis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole
SMILESC1=NCCN1.C1=NCCN1.c1ccc(-c2cc3ccccc3[nH]2)cc1
InChIInChI=1S/C14H11N.2C3H6N2/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14;2*1-2-5-3-4-1/h1-10,15H;2*3H,1-2H2,(H,4,5)
InChIKeyJSTDGMPDQYKAMJ-UHFFFAOYSA-N
MW333.44 g/mol
LogP3.07
Rot. Bonds1

About bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole

bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole (PubChem CID 175419322) has the molecular formula C20H23N5 and a molecular weight of 333.44 g/mol. Its IUPAC name is bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole.

Molecular Properties

Compound Namebis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole
PubChem CID175419322
Molecular FormulaC20H23N5
Molecular Weight333.44 g/mol
Exact Mass333.20
IUPAC Namebis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole
SMILESC1=NCCN1.C1=NCCN1.c1ccc(-c2cc3ccccc3[nH]2)cc1
InChIInChI=1S/C14H11N.2C3H6N2/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14;2*1-2-5-3-4-1/h1-10,15H;2*3H,1-2H2,(H,4,5)
InChIKeyJSTDGMPDQYKAMJ-UHFFFAOYSA-N
XLogP3.07
TPSA64.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 53.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

bis(1H-imidazole);2-phenyl-1H-indole
CID 175361199
4-(1H-indol-2-yl)phenol
CID 11287260
2-pyridin-3-yl-1H-indole
CID 606677
2-(4-pyridin-3-ylphenyl)-1H-indole
CID 91518635
2-[4-(4-phenylpiperazin-1-yl)phenyl]-1H-indole
CID 163366166
2-pyridin-3-yl-1H-indole;hydrochloride
CID 159150480
2-phenyl-1H-pyrrolo[2,3-c]pyridine
CID 11480986
2-(2,6-diphenylphenyl)-1H-indole
CID 135023242
aniline;4,5-dihydro-1H-imidazole
CID 159427838
4-(1H-indol-2-yl)benzenethiol;methanol
CID 160504693
4-(1H-indol-2-yl)-N-methylaniline
CID 116995134
2-(1H-diazirin-3-yl)-1H-indole
CID 137250152

Frequently Asked Questions

What is the IUPAC name of bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole?
The IUPAC name of bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole (CID 175419322) is bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole.
What is the SMILES notation for bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole?
The canonical SMILES for bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole is C1=NCCN1.C1=NCCN1.c1ccc(-c2cc3ccccc3[nH]2)cc1.
What is the InChIKey of bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole?
The InChIKey is JSTDGMPDQYKAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N.2C3H6N2/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14;2*1-2-5-3-4-1/h1-10,15H;2*3H,1-2H2,(H,4,5).
What are the key properties of bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole?
bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole has a molecular weight of 333.44 g/mol, XLogP of 3.07, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4,5-dihydro-1H-imidazole);2-phenyl-1H-indole is sourced from PubChem (CID 175419322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).