4-chloro-3-morpholin-4-ylbenzohydrazide

C11H14ClN3O2 — CID 7148384

IUPAC4-chloro-3-morpholin-4-ylbenzohydrazide
SMILESNNC(=O)c1ccc(Cl)c(N2CCOCC2)c1
InChIInChI=1S/C11H14ClN3O2/c12-9-2-1-8(11(16)14-13)7-10(9)15-3-5-17-6-4-15/h1-2,7H,3-6,13H2,(H,14,16)
InChIKeyNPJHEVOSBJDOES-UHFFFAOYSA-N
MW255.70 g/mol
LogP0.78
Rot. Bonds2

About 4-chloro-3-morpholin-4-ylbenzohydrazide

4-chloro-3-morpholin-4-ylbenzohydrazide (PubChem CID 7148384) has the molecular formula C11H14ClN3O2 and a molecular weight of 255.70 g/mol. Its IUPAC name is 4-chloro-3-morpholin-4-ylbenzohydrazide.

Molecular Properties

Compound Name4-chloro-3-morpholin-4-ylbenzohydrazide
PubChem CID7148384
Molecular FormulaC11H14ClN3O2
Molecular Weight255.70 g/mol
Exact Mass255.08
IUPAC Name4-chloro-3-morpholin-4-ylbenzohydrazide
SMILESNNC(=O)c1ccc(Cl)c(N2CCOCC2)c1
InChIInChI=1S/C11H14ClN3O2/c12-9-2-1-8(11(16)14-13)7-10(9)15-3-5-17-6-4-15/h1-2,7H,3-6,13H2,(H,14,16)
InChIKeyNPJHEVOSBJDOES-UHFFFAOYSA-N
XLogP0.78
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl 4-chloro-3-morpholin-4-ylbenzoate
CID 7148400
1-(4-chloro-3-morpholin-4-ylphenyl)-2-methylpropan-1-one
CID 82123223
4-morpholin-4-yl-3-(trifluoromethyl)benzohydrazide
CID 146425073
2-amino-1-(3-chloro-4-morpholin-4-ylphenyl)ethanone
CID 117390089
2-morpholin-4-ylbenzohydrazide
CID 7148386
ethyl 3-chloro-4-morpholin-4-ylbenzoate
CID 154210360
N-(4-amino-2-chloro-5-morpholin-4-ylphenyl)-4-chlorobenzamide
CID 50881482
4-chloro-3-pyrrolidin-1-ylbenzoic acid
CID 7148434
3,4-dichloro-N-(2,5-diethoxy-4-morpholin-4-ylphenyl)benzamide
CID 4853152
3-chloro-4-methyl-N-(2-morpholin-4-ylphenyl)benzamide
CID 898180
4-chloro-3-piperidin-1-ylbenzoic acid
CID 7148438
3,4-dichloro-N-[(2-morpholin-4-ylphenyl)carbamothioyl]benzamide
CID 1278265

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-morpholin-4-ylbenzohydrazide?
The IUPAC name of 4-chloro-3-morpholin-4-ylbenzohydrazide (CID 7148384) is 4-chloro-3-morpholin-4-ylbenzohydrazide.
What is the SMILES notation for 4-chloro-3-morpholin-4-ylbenzohydrazide?
The canonical SMILES for 4-chloro-3-morpholin-4-ylbenzohydrazide is NNC(=O)c1ccc(Cl)c(N2CCOCC2)c1.
What is the InChIKey of 4-chloro-3-morpholin-4-ylbenzohydrazide?
The InChIKey is NPJHEVOSBJDOES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O2/c12-9-2-1-8(11(16)14-13)7-10(9)15-3-5-17-6-4-15/h1-2,7H,3-6,13H2,(H,14,16).
What are the key properties of 4-chloro-3-morpholin-4-ylbenzohydrazide?
4-chloro-3-morpholin-4-ylbenzohydrazide has a molecular weight of 255.70 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-morpholin-4-ylbenzohydrazide is sourced from PubChem (CID 7148384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).