N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide

C11H13ClN2O — CID 67066751

IUPACN'-(3-chlorophenyl)-2-cyclopropylacetohydrazide
SMILESO=C(CC1CC1)NNc1cccc(Cl)c1
InChIInChI=1S/C11H13ClN2O/c12-9-2-1-3-10(7-9)13-14-11(15)6-8-4-5-8/h1-3,7-8,13H,4-6H2,(H,14,15)
InChIKeyDAJKIAKENTUFDK-UHFFFAOYSA-N
MW224.69 g/mol
LogP2.58
Rot. Bonds4

About N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide

N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide (PubChem CID 67066751) has the molecular formula C11H13ClN2O and a molecular weight of 224.69 g/mol. Its IUPAC name is N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide.

Molecular Properties

Compound NameN'-(3-chlorophenyl)-2-cyclopropylacetohydrazide
PubChem CID67066751
Molecular FormulaC11H13ClN2O
Molecular Weight224.69 g/mol
Exact Mass224.07
IUPAC NameN'-(3-chlorophenyl)-2-cyclopropylacetohydrazide
SMILESO=C(CC1CC1)NNc1cccc(Cl)c1
InChIInChI=1S/C11H13ClN2O/c12-9-2-1-3-10(7-9)13-14-11(15)6-8-4-5-8/h1-3,7-8,13H,4-6H2,(H,14,15)
InChIKeyDAJKIAKENTUFDK-UHFFFAOYSA-N
XLogP2.58
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.69
LogP ≤ 52.58
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'-(3-chlorophenyl)-2-cyclopropylacetohydrazide?
The IUPAC name of N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide (CID 67066751) is N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide.
What is the SMILES notation for N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide?
The canonical SMILES for N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide is O=C(CC1CC1)NNc1cccc(Cl)c1.
What is the InChIKey of N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide?
The InChIKey is DAJKIAKENTUFDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O/c12-9-2-1-3-10(7-9)13-14-11(15)6-8-4-5-8/h1-3,7-8,13H,4-6H2,(H,14,15).
What are the key properties of N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide?
N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide has a molecular weight of 224.69 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-chlorophenyl)-2-cyclopropylacetohydrazide is sourced from PubChem (CID 67066751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).