5,6-dichloro-3-nitropyridin-2-amine

C5H3Cl2N3O2 — CID 15392047

IUPAC5,6-dichloro-3-nitropyridin-2-amine
SMILESNc1nc(Cl)c(Cl)cc1[N+](=O)[O-]
InChIInChI=1S/C5H3Cl2N3O2/c6-2-1-3(10(11)12)5(8)9-4(2)7/h1H,(H2,8,9)
InChIKeyDYSLEQUCBXITJX-UHFFFAOYSA-N
MW208.00 g/mol
LogP1.88
Rot. Bonds1

About 5,6-dichloro-3-nitropyridin-2-amine

5,6-dichloro-3-nitropyridin-2-amine (PubChem CID 15392047) has the molecular formula C5H3Cl2N3O2 and a molecular weight of 208.00 g/mol. Its IUPAC name is 5,6-dichloro-3-nitropyridin-2-amine.

Molecular Properties

Compound Name5,6-dichloro-3-nitropyridin-2-amine
PubChem CID15392047
Molecular FormulaC5H3Cl2N3O2
Molecular Weight208.00 g/mol
Exact Mass206.96
IUPAC Name5,6-dichloro-3-nitropyridin-2-amine
SMILESNc1nc(Cl)c(Cl)cc1[N+](=O)[O-]
InChIInChI=1S/C5H3Cl2N3O2/c6-2-1-3(10(11)12)5(8)9-4(2)7/h1H,(H2,8,9)
InChIKeyDYSLEQUCBXITJX-UHFFFAOYSA-N
XLogP1.88
TPSA82.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.00
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 5,6-dichloro-3-nitropyridin-2-amine 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

6-chloro-5-(difluoromethyl)-3-nitropyridin-2-amine
CID 119012355
4-(6-amino-2-chloro-5-nitro-3-pyridinyl)-3,4-dihydroxybutanenitrile
CID 171901686
ethyl 3-(6-amino-2-chloro-5-nitro-3-pyridinyl)-2,3-dihydroxypropanoate
CID 171866820
6-chloro-5-nitropyridin-2-amine
CID 3069277
2,3,5-trichloro-6-(5-methyl-2-nitrophenoxy)pyridine
CID 102749610
4-chloro-5-fluoro-2-nitroaniline
CID 10465141
2-(3,4-dichlorophenyl)sulfanyl-5-nitropyrimidin-4-amine
CID 133324022
3,4-dichloro-5-nitroaniline
CID 121228417
6,7-dichloro-3-nitro-1H-1,8-naphthyridin-4-one
CID 175866851
2,4-dichloro-6-(4,5-dichloro-2-nitrophenoxy)-1,3,5-triazine
CID 107499610
7-fluoro-6-nitroquinazoline-2,4-diamine
CID 7103331
3-amino-7-chloro-6-nitro-1H-quinoxalin-2-one
CID 10752580

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-3-nitropyridin-2-amine?
The IUPAC name of 5,6-dichloro-3-nitropyridin-2-amine (CID 15392047) is 5,6-dichloro-3-nitropyridin-2-amine.
What is the SMILES notation for 5,6-dichloro-3-nitropyridin-2-amine?
The canonical SMILES for 5,6-dichloro-3-nitropyridin-2-amine is Nc1nc(Cl)c(Cl)cc1[N+](=O)[O-].
What is the InChIKey of 5,6-dichloro-3-nitropyridin-2-amine?
The InChIKey is DYSLEQUCBXITJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3Cl2N3O2/c6-2-1-3(10(11)12)5(8)9-4(2)7/h1H,(H2,8,9).
What are the key properties of 5,6-dichloro-3-nitropyridin-2-amine?
5,6-dichloro-3-nitropyridin-2-amine has a molecular weight of 208.00 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-3-nitropyridin-2-amine is sourced from PubChem (CID 15392047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).