4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide

C11H17N3O3S — CID 92863678

IUPAC4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide
SMILESCCc1ccc(/C(N)=N\O)cc1NS(=O)(=O)CC
InChIInChI=1S/C11H17N3O3S/c1-3-8-5-6-9(11(12)13-15)7-10(8)14-18(16,17)4-2/h5-7,14-15H,3-4H2,1-2H3,(H2,12,13)
InChIKeyDKXVLHNIYYOZJH-UHFFFAOYSA-N
MW271.34 g/mol
LogP1.11
Rot. Bonds5

About 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide

4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide (PubChem CID 92863678) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide.

Molecular Properties

Compound Name4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide
PubChem CID92863678
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC Name4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide
SMILESCCc1ccc(/C(N)=N\O)cc1NS(=O)(=O)CC
InChIInChI=1S/C11H17N3O3S/c1-3-8-5-6-9(11(12)13-15)7-10(8)14-18(16,17)4-2/h5-7,14-15H,3-4H2,1-2H3,(H2,12,13)
InChIKeyDKXVLHNIYYOZJH-UHFFFAOYSA-N
XLogP1.11
TPSA104.78 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2,2-dimethylpropylsulfonylamino)-N'-hydroxy-4-methylbenzenecarboximidamide
CID 77045066
N'-hydroxy-3-(3-methoxypropylsulfonylamino)-4-methylbenzenecarboximidamide
CID 76994146
3-chloro-N'-hydroxy-4-(3-methoxypropylsulfonylamino)benzenecarboximidamide
CID 107810010
4-(dimethylsulfamoylamino)-N'-hydroxy-3-methoxybenzenecarboximidamide
CID 104849976
methyl 2-[2-fluoro-4-(N'-hydroxycarbamimidoyl)phenyl]acetate
CID 86721971
3-fluoro-N'-hydroxy-4-[(3-methylsulfonylpropylamino)methyl]benzenecarboximidamide
CID 77031947
3-fluoro-N'-hydroxy-4-[(2-methylpropylsulfamoylamino)methyl]benzenecarboximidamide
CID 114816592
ethyl N-[5-(N'-hydroxycarbamimidoyl)-2-methylphenyl]carbamate
CID 76935517
4-[(cyclopropylsulfamoylamino)methyl]-3-fluoro-N'-hydroxybenzenecarboximidamide
CID 114812348
3-chloro-4-(dimethylsulfamoylamino)-N'-hydroxybenzenecarboximidamide
CID 114003616
N-[5-[(Z)-N'-hydroxycarbamimidoyl]-2-methylphenyl]butanamide
CID 62104147
3-fluoro-N'-hydroxy-4-(hydroxymethyl)benzenecarboximidamide
CID 50941129

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide?
The IUPAC name of 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide (CID 92863678) is 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide.
What is the SMILES notation for 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide?
The canonical SMILES for 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide is CCc1ccc(/C(N)=N\O)cc1NS(=O)(=O)CC.
What is the InChIKey of 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide?
The InChIKey is DKXVLHNIYYOZJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-3-8-5-6-9(11(12)13-15)7-10(8)14-18(16,17)4-2/h5-7,14-15H,3-4H2,1-2H3,(H2,12,13).
What are the key properties of 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide?
4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide has a molecular weight of 271.34 g/mol, XLogP of 1.11, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-(ethylsulfonylamino)-N'-hydroxybenzenecarboximidamide is sourced from PubChem (CID 92863678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).