N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide

C19H18N4O3 — CID 47063106

IUPACN-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide
SMILESO=C(COc1cccc(NC(=O)Cn2cccn2)c1)Nc1ccccc1
InChIInChI=1S/C19H18N4O3/c24-18(13-23-11-5-10-20-23)22-16-8-4-9-17(12-16)26-14-19(25)21-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,21,25)(H,22,24)
InChIKeySDUMXADVJMCAGN-UHFFFAOYSA-N
MW350.38 g/mol
LogP2.54
Rot. Bonds7

About N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide

N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide (PubChem CID 47063106) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide
PubChem CID47063106
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC NameN-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide
SMILESO=C(COc1cccc(NC(=O)Cn2cccn2)c1)Nc1ccccc1
InChIInChI=1S/C19H18N4O3/c24-18(13-23-11-5-10-20-23)22-16-8-4-9-17(12-16)26-14-19(25)21-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,21,25)(H,22,24)
InChIKeySDUMXADVJMCAGN-UHFFFAOYSA-N
XLogP2.54
TPSA85.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-phenoxyphenyl)-2-pyrazol-1-ylacetamide
CID 51272460
N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-pyrazol-1-ylacetamide
CID 47029028
N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-(4-bromophenoxy)acetamide
CID 55901957
N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-(4-bromophenyl)acetamide
CID 55902721
2-(4-ethoxyphenoxy)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 39694973
N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-(cyclopropylmethylamino)acetamide
CID 119723904
N-[3-[(2-phenoxyacetyl)amino]phenyl]-2-pyrazol-1-ylpropanamide
CID 42958650
2-(3-fluorophenoxy)-N-phenylacetamide
CID 2709732
N-[3-[[[2-(2-oxochromen-7-yl)oxyacetyl]amino]methyl]phenyl]-2-pyrazol-1-ylacetamide
CID 55954154
3-(5-phenylfuran-2-yl)-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
CID 55767669
N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 39041372
N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]-2-(4-pyrazol-1-ylphenyl)acetamide
CID 46473158

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide?
The IUPAC name of N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide (CID 47063106) is N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide is O=C(COc1cccc(NC(=O)Cn2cccn2)c1)Nc1ccccc1.
What is the InChIKey of N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide?
The InChIKey is SDUMXADVJMCAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c24-18(13-23-11-5-10-20-23)22-16-8-4-9-17(12-16)26-14-19(25)21-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,21,25)(H,22,24).
What are the key properties of N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide?
N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide has a molecular weight of 350.38 g/mol, XLogP of 2.54, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 47063106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).