N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide

C20H18N4O — CID 37193450

IUPACN-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide
SMILESO=C(CCn1ccc2ccccc21)Nc1ccc(-n2ccnc2)cc1
InChIInChI=1S/C20H18N4O/c25-20(10-13-23-12-9-16-3-1-2-4-19(16)23)22-17-5-7-18(8-6-17)24-14-11-21-15-24/h1-9,11-12,14-15H,10,13H2,(H,22,25)
InChIKeyPKJAEFJEWSEIRY-UHFFFAOYSA-N
MW330.39 g/mol
LogP3.86
Rot. Bonds5

About N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide

N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide (PubChem CID 37193450) has the molecular formula C20H18N4O and a molecular weight of 330.39 g/mol. Its IUPAC name is N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide.

Molecular Properties

Compound NameN-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide
PubChem CID37193450
Molecular FormulaC20H18N4O
Molecular Weight330.39 g/mol
Exact Mass330.15
IUPAC NameN-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide
SMILESO=C(CCn1ccc2ccccc21)Nc1ccc(-n2ccnc2)cc1
InChIInChI=1S/C20H18N4O/c25-20(10-13-23-12-9-16-3-1-2-4-19(16)23)22-17-5-7-18(8-6-17)24-14-11-21-15-24/h1-9,11-12,14-15H,10,13H2,(H,22,25)
InChIKeyPKJAEFJEWSEIRY-UHFFFAOYSA-N
XLogP3.86
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-aminophenyl)-3-indol-1-ylpropanamide
CID 43247263
3-indol-1-yl-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 42392939
N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide
CID 87039583
3-indol-1-yl-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
CID 27702119
3-(2,5-dioxopyrrolidin-1-yl)-N-(4-imidazol-1-ylphenyl)propanamide
CID 37193063
3-(1H-benzimidazol-2-yl)-N-(4-imidazol-1-ylphenyl)propanamide
CID 31409989
N-(5-bromonaphthalen-2-yl)-3-indol-1-ylpropanamide
CID 146022047
2-[2-(4-imidazol-1-ylanilino)-2-oxoethyl]benzoic acid
CID 56762074
3-indol-1-yl-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 9257089
ethyl (E)-3-[4-(3-indol-1-ylpropanoylamino)phenyl]prop-2-enoate
CID 27054675
3-indol-1-yl-N-[1-(pyridin-3-ylmethyl)pyrazol-3-yl]propanamide
CID 51101885
N-(4-imidazol-1-ylphenyl)acetamide
CID 16761727

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide?
The IUPAC name of N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide (CID 37193450) is N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide.
What is the SMILES notation for N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide?
The canonical SMILES for N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide is O=C(CCn1ccc2ccccc21)Nc1ccc(-n2ccnc2)cc1.
What is the InChIKey of N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide?
The InChIKey is PKJAEFJEWSEIRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O/c25-20(10-13-23-12-9-16-3-1-2-4-19(16)23)22-17-5-7-18(8-6-17)24-14-11-21-15-24/h1-9,11-12,14-15H,10,13H2,(H,22,25).
What are the key properties of N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide?
N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide has a molecular weight of 330.39 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide is sourced from PubChem (CID 37193450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).