N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine

C6H8ClN3O — CID 135265282

IUPACN-amino-N-(2-amino-5-chlorophenyl)hydroxylamine
SMILESNc1ccc(Cl)cc1N(N)O
InChIInChI=1S/C6H8ClN3O/c7-4-1-2-5(8)6(3-4)10(9)11/h1-3,11H,8-9H2
InChIKeyOXFUJKFJHZEXQQ-UHFFFAOYSA-N
MW173.60 g/mol
LogP0.99
Rot. Bonds1

About N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine

N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine (PubChem CID 135265282) has the molecular formula C6H8ClN3O and a molecular weight of 173.60 g/mol. Its IUPAC name is N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine.

Molecular Properties

Compound NameN-amino-N-(2-amino-5-chlorophenyl)hydroxylamine
PubChem CID135265282
Molecular FormulaC6H8ClN3O
Molecular Weight173.60 g/mol
Exact Mass173.04
IUPAC NameN-amino-N-(2-amino-5-chlorophenyl)hydroxylamine
SMILESNc1ccc(Cl)cc1N(N)O
InChIInChI=1S/C6H8ClN3O/c7-4-1-2-5(8)6(3-4)10(9)11/h1-3,11H,8-9H2
InChIKeyOXFUJKFJHZEXQQ-UHFFFAOYSA-N
XLogP0.99
TPSA75.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.60
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(N,2-diamino-5-chloroanilino)acetic acid
CID 165131295
N-(2-amino-5-chlorophenyl)-N-methylacetamide
CID 107465702
2-N-butyl-4-chloro-2-N-ethylbenzene-1,2-diamine
CID 115468453
N-(2-amino-5-chlorophenyl)-N,2,2-trimethylpropanamide
CID 107465612
4-chloro-2-N-[2-(dimethylamino)ethyl]-2-N-methylbenzene-1,2-diamine
CID 115468988
2-(2-amino-5-chloro-N-methylanilino)-N,N-dimethylacetamide
CID 115468609
4-chloro-2-N-ethyl-2-N-methoxybenzene-1,2-diamine
CID 130512868
4-(2-amino-5-chloro-N-methylanilino)-2-methylbutan-2-ol
CID 107466176
4-chloro-2-N-[3-(dimethylamino)propyl]-2-N-ethylbenzene-1,2-diamine
CID 102991096
N-(2-amino-5-chlorophenyl)-N-methylbenzamide
CID 107465675
2-amino-5-chlorobenzenethiol;hydrochloride
CID 70156198
4-chloro-2-N-(3,4-difluorophenyl)-2-N-methylbenzene-1,2-diamine
CID 115127668

Frequently Asked Questions

What is the IUPAC name of N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine?
The IUPAC name of N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine (CID 135265282) is N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine.
What is the SMILES notation for N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine?
The canonical SMILES for N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine is Nc1ccc(Cl)cc1N(N)O.
What is the InChIKey of N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine?
The InChIKey is OXFUJKFJHZEXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN3O/c7-4-1-2-5(8)6(3-4)10(9)11/h1-3,11H,8-9H2.
What are the key properties of N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine?
N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine has a molecular weight of 173.60 g/mol, XLogP of 0.99, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N-(2-amino-5-chlorophenyl)hydroxylamine is sourced from PubChem (CID 135265282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).