N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide

C19H17ClN4O2 — CID 86845072

IUPACN-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide
SMILESCC(=O)Nc1cc(NC(=O)Cc2ccc(-n3cccn3)cc2)ccc1Cl
InChIInChI=1S/C19H17ClN4O2/c1-13(25)22-18-12-15(5-8-17(18)20)23-19(26)11-14-3-6-16(7-4-14)24-10-2-9-21-24/h2-10,12H,11H2,1H3,(H,22,25)(H,23,26)
InChIKeyMAGVIQPMWCNPLM-UHFFFAOYSA-N
MW368.82 g/mol
LogP3.67
Rot. Bonds5

About N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide

N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide (PubChem CID 86845072) has the molecular formula C19H17ClN4O2 and a molecular weight of 368.82 g/mol. Its IUPAC name is N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide
PubChem CID86845072
Molecular FormulaC19H17ClN4O2
Molecular Weight368.82 g/mol
Exact Mass368.10
IUPAC NameN-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide
SMILESCC(=O)Nc1cc(NC(=O)Cc2ccc(-n3cccn3)cc2)ccc1Cl
InChIInChI=1S/C19H17ClN4O2/c1-13(25)22-18-12-15(5-8-17(18)20)23-19(26)11-14-3-6-16(7-4-14)24-10-2-9-21-24/h2-10,12H,11H2,1H3,(H,22,25)(H,23,26)
InChIKeyMAGVIQPMWCNPLM-UHFFFAOYSA-N
XLogP3.67
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.82
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[acetyl(methyl)amino]phenyl]-2-(4-pyrazol-1-ylphenyl)acetamide
CID 86857797
N-(9H-fluoren-2-yl)-2-(4-pyrazol-1-ylphenyl)acetamide
CID 46472205
N-(3-acetamido-4-chlorophenyl)-2-(2-phenyltriazol-4-yl)acetamide
CID 155945833
N-(2,6-diethylphenyl)-2-(4-pyrazol-1-ylphenyl)acetamide
CID 86997630
N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]-2-(4-pyrazol-1-ylphenyl)acetamide
CID 46473158
2-(3-methoxyphenyl)-N-(4-pyrazol-1-ylphenyl)acetamide
CID 31907046
4-(3-acetamido-4-chloroanilino)-4-oxobutanoic acid
CID 881020
N-(5-bromo-4-chloro-3-pyridinyl)-2-(4-pyrazol-1-ylphenyl)acetamide
CID 71911669
N-[4-(3-oxopiperazin-1-yl)phenyl]-2-(4-pyrazol-1-ylphenyl)acetamide
CID 78876546
(2R)-N-[4-[[2-(4-pyrazol-1-ylphenyl)acetyl]amino]phenyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 51948969
N-[3-[(2-aminoacetyl)amino]-4-chlorophenyl]-2-phenylacetamide
CID 39184468
2-(4-pyrazol-1-ylphenyl)-N-quinolin-8-ylacetamide
CID 47035823

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide?
The IUPAC name of N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide (CID 86845072) is N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide.
What is the SMILES notation for N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide?
The canonical SMILES for N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide is CC(=O)Nc1cc(NC(=O)Cc2ccc(-n3cccn3)cc2)ccc1Cl.
What is the InChIKey of N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide?
The InChIKey is MAGVIQPMWCNPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O2/c1-13(25)22-18-12-15(5-8-17(18)20)23-19(26)11-14-3-6-16(7-4-14)24-10-2-9-21-24/h2-10,12H,11H2,1H3,(H,22,25)(H,23,26).
What are the key properties of N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide?
N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide has a molecular weight of 368.82 g/mol, XLogP of 3.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-chlorophenyl)-2-(4-pyrazol-1-ylphenyl)acetamide is sourced from PubChem (CID 86845072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).