N'-(5-chloro-2-methylphenyl)acetohydrazide

C9H11ClN2O — CID 607664

IUPACN'-(5-chloro-2-methylphenyl)acetohydrazide
SMILESCC(=O)NNc1cc(Cl)ccc1C
InChIInChI=1S/C9H11ClN2O/c1-6-3-4-8(10)5-9(6)12-11-7(2)13/h3-5,12H,1-2H3,(H,11,13)
InChIKeyUVPDSLVHKYYTRJ-UHFFFAOYSA-N
MW198.65 g/mol
LogP2.11
Rot. Bonds2

About N'-(5-chloro-2-methylphenyl)acetohydrazide

N'-(5-chloro-2-methylphenyl)acetohydrazide (PubChem CID 607664) has the molecular formula C9H11ClN2O and a molecular weight of 198.65 g/mol. Its IUPAC name is N'-(5-chloro-2-methylphenyl)acetohydrazide.

Molecular Properties

Compound NameN'-(5-chloro-2-methylphenyl)acetohydrazide
PubChem CID607664
Molecular FormulaC9H11ClN2O
Molecular Weight198.65 g/mol
Exact Mass198.06
IUPAC NameN'-(5-chloro-2-methylphenyl)acetohydrazide
SMILESCC(=O)NNc1cc(Cl)ccc1C
InChIInChI=1S/C9H11ClN2O/c1-6-3-4-8(10)5-9(6)12-11-7(2)13/h3-5,12H,1-2H3,(H,11,13)
InChIKeyUVPDSLVHKYYTRJ-UHFFFAOYSA-N
XLogP2.11
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.65
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(5-chloro-2-methylphenyl)acetohydrazide?
The IUPAC name of N'-(5-chloro-2-methylphenyl)acetohydrazide (CID 607664) is N'-(5-chloro-2-methylphenyl)acetohydrazide.
What is the SMILES notation for N'-(5-chloro-2-methylphenyl)acetohydrazide?
The canonical SMILES for N'-(5-chloro-2-methylphenyl)acetohydrazide is CC(=O)NNc1cc(Cl)ccc1C.
What is the InChIKey of N'-(5-chloro-2-methylphenyl)acetohydrazide?
The InChIKey is UVPDSLVHKYYTRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O/c1-6-3-4-8(10)5-9(6)12-11-7(2)13/h3-5,12H,1-2H3,(H,11,13).
What are the key properties of N'-(5-chloro-2-methylphenyl)acetohydrazide?
N'-(5-chloro-2-methylphenyl)acetohydrazide has a molecular weight of 198.65 g/mol, XLogP of 2.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-chloro-2-methylphenyl)acetohydrazide is sourced from PubChem (CID 607664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).