5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide

C15H22ClN3O — CID 62248307

IUPAC5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide
SMILESCCN(C(=O)c1cc(Cl)ccc1NN)C1CCCCC1
InChIInChI=1S/C15H22ClN3O/c1-2-19(12-6-4-3-5-7-12)15(20)13-10-11(16)8-9-14(13)18-17/h8-10,12,18H,2-7,17H2,1H3
InChIKeyJPQJWOCGNRHSTK-UHFFFAOYSA-N
MW295.81 g/mol
LogP3.42
Rot. Bonds4

About 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide

5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide (PubChem CID 62248307) has the molecular formula C15H22ClN3O and a molecular weight of 295.81 g/mol. Its IUPAC name is 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide.

Molecular Properties

Compound Name5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide
PubChem CID62248307
Molecular FormulaC15H22ClN3O
Molecular Weight295.81 g/mol
Exact Mass295.15
IUPAC Name5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide
SMILESCCN(C(=O)c1cc(Cl)ccc1NN)C1CCCCC1
InChIInChI=1S/C15H22ClN3O/c1-2-19(12-6-4-3-5-7-12)15(20)13-10-11(16)8-9-14(13)18-17/h8-10,12,18H,2-7,17H2,1H3
InChIKeyJPQJWOCGNRHSTK-UHFFFAOYSA-N
XLogP3.42
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-chloro-N-cyclopentyl-N-ethylbenzamide
CID 43540646
5-chloro-N-cyclohexyl-N-(2-hydroxyethyl)-2-(methylamino)benzamide
CID 62174801
5-chloro-N-cyclopropyl-2-hydrazinyl-N-methylbenzamide
CID 62243364
N-cyclopentyl-N-ethyl-4-hydrazinylpyridine-3-carboxamide
CID 81256694
4-amino-2-chloro-N-cyclohexyl-N-ethylbenzamide
CID 16787456
N-cyclopentyl-N-ethyl-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256597
5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide
CID 62242599
N-butan-2-yl-5-chloro-N-ethyl-2-hydrazinylbenzamide
CID 62241178
5-chloro-N-ethyl-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
CID 62236604
5-chloro-N-ethyl-2-fluoro-N-piperidin-3-ylbenzamide
CID 63637963
N-cyclohexyl-N-ethyl-4-hydrazinylbenzamide
CID 62248667
5-chloro-N-cyclohexyl-2-hydrazinylbenzamide
CID 62237687

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide?
The IUPAC name of 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide (CID 62248307) is 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide.
What is the SMILES notation for 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide?
The canonical SMILES for 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide is CCN(C(=O)c1cc(Cl)ccc1NN)C1CCCCC1.
What is the InChIKey of 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide?
The InChIKey is JPQJWOCGNRHSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3O/c1-2-19(12-6-4-3-5-7-12)15(20)13-10-11(16)8-9-14(13)18-17/h8-10,12,18H,2-7,17H2,1H3.
What are the key properties of 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide?
5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide has a molecular weight of 295.81 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide is sourced from PubChem (CID 62248307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).