5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide

C11H15Cl2N3O — CID 77025830

IUPAC5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide
SMILESNC(CCCCNc1cc(Cl)cc(Cl)c1)=NO
InChIInChI=1S/C11H15Cl2N3O/c12-8-5-9(13)7-10(6-8)15-4-2-1-3-11(14)16-17/h5-7,15,17H,1-4H2,(H2,14,16)
InChIKeyMBWNBOUWLSUHQP-UHFFFAOYSA-N
MW276.17 g/mol
LogP3.32
Rot. Bonds6

About 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide

5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide (PubChem CID 77025830) has the molecular formula C11H15Cl2N3O and a molecular weight of 276.17 g/mol. Its IUPAC name is 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide.

Molecular Properties

Compound Name5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide
PubChem CID77025830
Molecular FormulaC11H15Cl2N3O
Molecular Weight276.17 g/mol
Exact Mass275.06
IUPAC Name5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide
SMILESNC(CCCCNc1cc(Cl)cc(Cl)c1)=NO
InChIInChI=1S/C11H15Cl2N3O/c12-8-5-9(13)7-10(6-8)15-4-2-1-3-11(14)16-17/h5-7,15,17H,1-4H2,(H2,14,16)
InChIKeyMBWNBOUWLSUHQP-UHFFFAOYSA-N
XLogP3.32
TPSA70.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.17
LogP ≤ 53.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide 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

5-(3,4-dichloroanilino)-N'-hydroxypentanimidamide
CID 77026091
1-[(4E)-4-amino-4-hydroxyiminobutyl]-3-(3,5-dichlorophenyl)urea
CID 107654487
N'-hydroxy-5-(3-methylanilino)pentanimidamide
CID 77025899
5-(3-fluoro-5-methoxyanilino)-N'-hydroxypentanimidamide
CID 114263134
4-[(5-amino-5-hydroxyiminopentyl)amino]benzamide
CID 77025709
5-(3-bromo-5-methoxyanilino)-N'-hydroxypentanimidamide
CID 82867428
5-(3,5-dichloroanilino)pentan-1-ol
CID 62227515
5-(5-bromo-2-fluoroanilino)-N'-hydroxypentanimidamide
CID 77027557
5-(2-chloro-5-iodoanilino)-N'-hydroxypentanimidamide
CID 114260347
5-[4-(dimethylamino)anilino]-N'-hydroxypentanimidamide
CID 77029852
4-(3-bromo-5-methylanilino)-N'-hydroxybutanimidamide
CID 107584120
5-[(3-chlorophenyl)methylamino]-N'-hydroxypentanimidamide
CID 77030098

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide?
The IUPAC name of 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide (CID 77025830) is 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide.
What is the SMILES notation for 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide?
The canonical SMILES for 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide is NC(CCCCNc1cc(Cl)cc(Cl)c1)=NO.
What is the InChIKey of 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide?
The InChIKey is MBWNBOUWLSUHQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Cl2N3O/c12-8-5-9(13)7-10(6-8)15-4-2-1-3-11(14)16-17/h5-7,15,17H,1-4H2,(H2,14,16).
What are the key properties of 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide?
5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide has a molecular weight of 276.17 g/mol, XLogP of 3.32, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dichloroanilino)-N'-hydroxypentanimidamide is sourced from PubChem (CID 77025830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).