N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide

C18H17N3O — CID 155548249

IUPACN-phenyl-3-(3-phenylpyrazol-1-yl)propanamide
SMILESO=C(CCn1ccc(-c2ccccc2)n1)Nc1ccccc1
InChIInChI=1S/C18H17N3O/c22-18(19-16-9-5-2-6-10-16)12-14-21-13-11-17(20-21)15-7-3-1-4-8-15/h1-11,13H,12,14H2,(H,19,22)
InChIKeyROYAFZRZMYXBIR-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.58
Rot. Bonds5

About N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide

N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide (PubChem CID 155548249) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-phenyl-3-(3-phenylpyrazol-1-yl)propanamide
PubChem CID155548249
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC NameN-phenyl-3-(3-phenylpyrazol-1-yl)propanamide
SMILESO=C(CCn1ccc(-c2ccccc2)n1)Nc1ccccc1
InChIInChI=1S/C18H17N3O/c22-18(19-16-9-5-2-6-10-16)12-14-21-13-11-17(20-21)15-7-3-1-4-8-15/h1-11,13H,12,14H2,(H,19,22)
InChIKeyROYAFZRZMYXBIR-UHFFFAOYSA-N
XLogP3.58
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-phenylpyrazol-1-yl)propanamide
CID 19835817
N-[4-(phenylcarbamoylamino)phenyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 24676944
N-(4-methylphenyl)-3-(6-oxo-3-phenylpyridazin-1-yl)propanamide
CID 91061296
3-(4-chloro-3-methylpyrazol-1-yl)-N-phenylpropanamide
CID 19544009
N-carbamoyl-3-[3-(4-fluorophenyl)pyrazol-1-yl]propanamide
CID 75432706
N-[2-(3-phenylpyrazol-1-yl)ethyl]formamide
CID 118524378
N-phenyl-3-(4-pyrrol-1-ylpyrazol-1-yl)propanamide
CID 75432738
3-phenyl-1-[2-[2-(3-phenylpyrazol-1-yl)ethoxy]ethyl]pyrazole
CID 11684541
N-[3-(phenylcarbamoylamino)phenyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 24676210
N-(4-fluorophenyl)-3-(3-methylpyrazol-1-yl)propanamide
CID 46339386
1-(2-methylsulfonylethyl)-3-phenylpyrazole
CID 66015946
1-[3-oxo-3-(4-propan-2-ylanilino)propyl]pyrazole-3-carboxylic acid
CID 19470585

Frequently Asked Questions

What is the IUPAC name of N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide?
The IUPAC name of N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide (CID 155548249) is N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide?
The canonical SMILES for N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide is O=C(CCn1ccc(-c2ccccc2)n1)Nc1ccccc1.
What is the InChIKey of N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide?
The InChIKey is ROYAFZRZMYXBIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c22-18(19-16-9-5-2-6-10-16)12-14-21-13-11-17(20-21)15-7-3-1-4-8-15/h1-11,13H,12,14H2,(H,19,22).
What are the key properties of N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide?
N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide has a molecular weight of 291.35 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-3-(3-phenylpyrazol-1-yl)propanamide is sourced from PubChem (CID 155548249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).