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

C15H15N5O — CID 87039583

IUPACN-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide
SMILESO=C(CCn1cccn1)Nc1ccc(-n2ccnc2)cc1
InChIInChI=1S/C15H15N5O/c21-15(6-10-20-9-1-7-17-20)18-13-2-4-14(5-3-13)19-11-8-16-12-19/h1-5,7-9,11-12H,6,10H2,(H,18,21)
InChIKeyXPYTUDFULLHSER-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.10
Rot. Bonds5

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

N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide (PubChem CID 87039583) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide
PubChem CID87039583
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC NameN-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide
SMILESO=C(CCn1cccn1)Nc1ccc(-n2ccnc2)cc1
InChIInChI=1S/C15H15N5O/c21-15(6-10-20-9-1-7-17-20)18-13-2-4-14(5-3-13)19-11-8-16-12-19/h1-5,7-9,11-12H,6,10H2,(H,18,21)
InChIKeyXPYTUDFULLHSER-UHFFFAOYSA-N
XLogP2.10
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-piperidin-1-ylphenyl)-3-pyrazol-1-ylpropanamide
CID 87038105
3-(2,5-dioxopyrrolidin-1-yl)-N-(4-imidazol-1-ylphenyl)propanamide
CID 37193063
N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide
CID 37193450
N-(4-imidazol-1-ylphenyl)-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide
CID 118795948
N-[4-(difluoromethoxy)phenyl]-3-pyrazol-1-ylpropanamide
CID 47175480
N-[4-(cyclopropylcarbamoylamino)phenyl]-3-pyrazol-1-ylpropanamide
CID 87039151
N-(4-imidazol-1-ylphenyl)acetamide
CID 16761727
3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 31816779
2-(4-hydroxyphenyl)-N-(4-imidazol-1-ylphenyl)acetamide
CID 78845003
N-[4-[[(1R)-1-phenylethyl]amino]phenyl]-3-pyrazol-1-ylpropanamide
CID 97089030
N-(4-imidazol-1-ylphenyl)-3-(5-methyl-1,3-dioxoisoindol-2-yl)propanamide
CID 37186591
N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide
CID 37194021

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide?
The IUPAC name of N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide (CID 87039583) is N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide is O=C(CCn1cccn1)Nc1ccc(-n2ccnc2)cc1.
What is the InChIKey of N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide?
The InChIKey is XPYTUDFULLHSER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c21-15(6-10-20-9-1-7-17-20)18-13-2-4-14(5-3-13)19-11-8-16-12-19/h1-5,7-9,11-12H,6,10H2,(H,18,21).
What are the key properties of N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide?
N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide has a molecular weight of 281.32 g/mol, XLogP of 2.10, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 87039583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).