N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide

C17H15N3O2 — CID 51272460

IUPACN-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C17H15N3O2/c21-17(13-20-11-5-10-18-20)19-14-6-4-9-16(12-14)22-15-7-2-1-3-8-15/h1-12H,13H2,(H,19,21)
InChIKeyNQVAVNKKGVCAMH-UHFFFAOYSA-N
MW293.33 g/mol
LogP3.31
Rot. Bonds5

About N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide

N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide (PubChem CID 51272460) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide
PubChem CID51272460
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC NameN-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C17H15N3O2/c21-17(13-20-11-5-10-18-20)19-14-6-4-9-16(12-14)22-15-7-2-1-3-8-15/h1-12H,13H2,(H,19,21)
InChIKeyNQVAVNKKGVCAMH-UHFFFAOYSA-N
XLogP3.31
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide
CID 47063106
N,N-dimethyl-3-[(2-pyrazol-1-ylacetyl)amino]benzamide
CID 33366231
N-(3-phenoxyphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 4588904
3,3-diphenyl-N-[[3-[(2-pyrazol-1-ylacetyl)amino]phenyl]methyl]propanamide
CID 52719151
N-(3,4-difluorophenyl)-2-pyrazol-1-ylacetamide
CID 39724155
N-[3-[[(N-benzyl-N'-methylcarbamimidoyl)amino]methyl]phenyl]-2-pyrazol-1-ylacetamide
CID 110955024
1-[2-oxo-2-(3-phenoxyanilino)ethyl]piperidine-4-carboxylic acid
CID 119907077
4-chloro-N-(3-phenoxyphenyl)butanamide
CID 63308949
2-[[amino-(3-phenoxyanilino)methylidene]amino]-N-phenylacetamide
CID 111599308
2-pyrazol-1-yl-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 39723892
3-(5-phenylfuran-2-yl)-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
CID 55767669
N-(6-bromo-3-pyridinyl)-2-pyrazol-1-ylacetamide
CID 103789408

Frequently Asked Questions

What is the IUPAC name of N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide?
The IUPAC name of N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide (CID 51272460) is N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide is O=C(Cn1cccn1)Nc1cccc(Oc2ccccc2)c1.
What is the InChIKey of N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide?
The InChIKey is NQVAVNKKGVCAMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c21-17(13-20-11-5-10-18-20)19-14-6-4-9-16(12-14)22-15-7-2-1-3-8-15/h1-12H,13H2,(H,19,21).
What are the key properties of N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide?
N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide has a molecular weight of 293.33 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 51272460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).