5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide

C15H16ClN3OS — CID 62242599

IUPAC5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide
SMILESNNc1ccc(Cl)cc1C(=O)N(Cc1cccs1)C1CC1
InChIInChI=1S/C15H16ClN3OS/c16-10-3-6-14(18-17)13(8-10)15(20)19(11-4-5-11)9-12-2-1-7-21-12/h1-3,6-8,11,18H,4-5,9,17H2
InChIKeyFYRUSSVYRGMCNO-UHFFFAOYSA-N
MW321.83 g/mol
LogP3.49
Rot. Bonds5

About 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide

5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 62242599) has the molecular formula C15H16ClN3OS and a molecular weight of 321.83 g/mol. Its IUPAC name is 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound Name5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide
PubChem CID62242599
Molecular FormulaC15H16ClN3OS
Molecular Weight321.83 g/mol
Exact Mass321.07
IUPAC Name5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide
SMILESNNc1ccc(Cl)cc1C(=O)N(Cc1cccs1)C1CC1
InChIInChI=1S/C15H16ClN3OS/c16-10-3-6-14(18-17)13(8-10)15(20)19(11-4-5-11)9-12-2-1-7-21-12/h1-3,6-8,11,18H,4-5,9,17H2
InChIKeyFYRUSSVYRGMCNO-UHFFFAOYSA-N
XLogP3.49
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.83
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2,5-dichloro-N-cyclopropyl-N-(2-thiophen-2-ylethyl)benzamide
CID 71781417
5-chloro-2-hydrazinyl-N-(2-thiophen-2-ylethyl)benzamide
CID 62247405
5-chloro-N-cyclopropyl-2-hydrazinyl-N-methylbenzamide
CID 62243364
N-cyclopropyl-2,5-dimethyl-N-(thiophen-2-ylmethyl)thiophene-3-carboxamide
CID 134004531
5-chloro-N-cyclohexyl-N-ethyl-2-hydrazinylbenzamide
CID 62248307
N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 62242780
3-(4-chloro-2-methylphenyl)-1-cyclopropyl-1-(thiophen-2-ylmethyl)thiourea
CID 4616878
2-chloro-N-cyclopropyl-4-nitro-N-(thiophen-2-ylmethyl)benzamide
CID 37484213
N-cyclopropyl-3-hydroxy-2-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 82795082
N-cyclopropyl-3-fluoro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 115645728
5-amino-N-cyclopropyl-2-methyl-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 61107609
2-hydrazinyl-N,5-dimethyl-N-(thiophen-2-ylmethyl)benzamide
CID 62512507

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide (CID 62242599) is 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide is NNc1ccc(Cl)cc1C(=O)N(Cc1cccs1)C1CC1.
What is the InChIKey of 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is FYRUSSVYRGMCNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3OS/c16-10-3-6-14(18-17)13(8-10)15(20)19(11-4-5-11)9-12-2-1-7-21-12/h1-3,6-8,11,18H,4-5,9,17H2.
What are the key properties of 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide?
5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 321.83 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 62242599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).