N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide

C19H17ClN4O2 — CID 41483858

IUPACN'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide
SMILESO=C(Cc1ccc(Cl)cc1)NNC(=O)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C19H17ClN4O2/c20-17-8-4-14(5-9-17)12-18(25)22-23-19(26)16-6-2-15(3-7-16)13-24-11-1-10-21-24/h1-11H,12-13H2,(H,22,25)(H,23,26)
InChIKeyFHNHYWURUMTOAR-UHFFFAOYSA-N
MW368.82 g/mol
LogP2.59
Rot. Bonds5

About N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide

N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide (PubChem CID 41483858) has the molecular formula C19H17ClN4O2 and a molecular weight of 368.82 g/mol. Its IUPAC name is N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide.

Molecular Properties

Compound NameN'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide
PubChem CID41483858
Molecular FormulaC19H17ClN4O2
Molecular Weight368.82 g/mol
Exact Mass368.10
IUPAC NameN'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide
SMILESO=C(Cc1ccc(Cl)cc1)NNC(=O)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C19H17ClN4O2/c20-17-8-4-14(5-9-17)12-18(25)22-23-19(26)16-6-2-15(3-7-16)13-24-11-1-10-21-24/h1-11H,12-13H2,(H,22,25)(H,23,26)
InChIKeyFHNHYWURUMTOAR-UHFFFAOYSA-N
XLogP2.59
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 ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-chloro-N'-[4-(pyrazol-1-ylmethyl)benzoyl]benzohydrazide
CID 17468530
N'-[2-(2-methylphenoxy)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide
CID 17437529
N'-[2-(4-chlorophenyl)acetyl]-4-methylbenzohydrazide
CID 4936719
N'-[2-(4-chlorophenyl)acetyl]-4-phenoxybenzohydrazide
CID 31727117
4-(pyrazol-1-ylmethyl)-N-thiophen-3-ylbenzamide
CID 175249041
4-(pyrazol-1-ylmethyl)-N-(pyridin-4-ylmethyl)benzamide
CID 18136267
N-(2-methylpropyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 18136496
N-(3-hydroxybutyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 111429261
N-cyclopentyl-4-(pyrazol-1-ylmethyl)benzamide
CID 18136591
N'-[2-(4-chlorophenyl)acetyl]-4-[(2-oxopyrrolidin-1-yl)methyl]benzohydrazide
CID 30755522
N'-[2-(4-chlorophenyl)acetyl]-6-methylpyridine-3-carbohydrazide
CID 31117850
N-(5-methylhexan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide
CID 46688121

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide?
The IUPAC name of N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide (CID 41483858) is N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide.
What is the SMILES notation for N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide?
The canonical SMILES for N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide is O=C(Cc1ccc(Cl)cc1)NNC(=O)c1ccc(Cn2cccn2)cc1.
What is the InChIKey of N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide?
The InChIKey is FHNHYWURUMTOAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O2/c20-17-8-4-14(5-9-17)12-18(25)22-23-19(26)16-6-2-15(3-7-16)13-24-11-1-10-21-24/h1-11H,12-13H2,(H,22,25)(H,23,26).
What are the key properties of N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide?
N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide has a molecular weight of 368.82 g/mol, XLogP of 2.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-chlorophenyl)acetyl]-4-(pyrazol-1-ylmethyl)benzohydrazide is sourced from PubChem (CID 41483858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).