2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide

C19H11Cl2N5O6 — CID 4294395

IUPAC2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide
SMILESO=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)nc1
InChIInChI=1S/C19H11Cl2N5O6/c20-13-7-11(2-5-16(13)25(29)30)23-18(27)10-1-4-15(22-9-10)19(28)24-12-3-6-17(26(31)32)14(21)8-12/h1-9H,(H,23,27)(H,24,28)
InChIKeySGEMWZRPQLLPCG-UHFFFAOYSA-N
MW476.23 g/mol
LogP4.71
Rot. Bonds6

About 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide

2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide (PubChem CID 4294395) has the molecular formula C19H11Cl2N5O6 and a molecular weight of 476.23 g/mol. Its IUPAC name is 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide
PubChem CID4294395
Molecular FormulaC19H11Cl2N5O6
Molecular Weight476.23 g/mol
Exact Mass475.01
IUPAC Name2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide
SMILESO=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)nc1
InChIInChI=1S/C19H11Cl2N5O6/c20-13-7-11(2-5-16(13)25(29)30)23-18(27)10-1-4-15(22-9-10)19(28)24-12-3-6-17(26(31)32)14(21)8-12/h1-9H,(H,23,27)(H,24,28)
InChIKeySGEMWZRPQLLPCG-UHFFFAOYSA-N
XLogP4.71
TPSA157.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.23
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide 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

N-(3-chloro-4-nitrophenyl)-6-fluoropyridine-3-carboxamide
CID 78962697
3-bromo-4-chloro-N-(3-chloro-4-nitrophenyl)benzamide
CID 107999621
N-(4-bromo-3-chlorophenyl)-3-chloro-4-nitrobenzamide
CID 107619731
3,5-dibromo-N-(3-chloro-4-nitrophenyl)benzamide
CID 107980537
5-N-(3,4-dichlorophenyl)pyridine-2,5-dicarboxamide
CID 47460215
3-chloro-N-(3-chloro-4-nitrophenyl)pyridine-4-carboxamide
CID 79118519
3-amino-N-(3,4-dichlorophenyl)-4-nitrobenzamide
CID 62680652
N-(3,4-dichlorophenyl)-3-fluoro-4-nitrobenzamide
CID 62680379
N-(4-amino-3-nitrophenyl)-6-chloropyridine-3-carboxamide
CID 86248819
3-chloro-N-(6-methoxy-3-pyridinyl)-4-nitrobenzamide
CID 82776170
N-(3-bromo-4-nitrophenyl)-6-fluoropyridine-3-carboxamide
CID 82864244
N-(3-chloro-4-nitrophenyl)-5-iodothiophene-3-carboxamide
CID 78948733

Frequently Asked Questions

What is the IUPAC name of 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide?
The IUPAC name of 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide (CID 4294395) is 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide.
What is the SMILES notation for 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide?
The canonical SMILES for 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide is O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)nc1.
What is the InChIKey of 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide?
The InChIKey is SGEMWZRPQLLPCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Cl2N5O6/c20-13-7-11(2-5-16(13)25(29)30)23-18(27)10-1-4-15(22-9-10)19(28)24-12-3-6-17(26(31)32)14(21)8-12/h1-9H,(H,23,27)(H,24,28).
What are the key properties of 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide?
2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide has a molecular weight of 476.23 g/mol, XLogP of 4.71, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,5-N-bis(3-chloro-4-nitrophenyl)pyridine-2,5-dicarboxamide is sourced from PubChem (CID 4294395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).