2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde

C12H8Cl2N2O — CID 118996981

IUPAC2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde
SMILESNc1cc(C=O)c(-c2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C12H8Cl2N2O/c13-8-1-2-9(11(14)4-8)10-5-16-12(15)3-7(10)6-17/h1-6H,(H2,15,16)
InChIKeySVVMAIUAWBVBDH-UHFFFAOYSA-N
MW267.12 g/mol
LogP3.45
Rot. Bonds2

About 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde

2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde (PubChem CID 118996981) has the molecular formula C12H8Cl2N2O and a molecular weight of 267.12 g/mol. Its IUPAC name is 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde.

Molecular Properties

Compound Name2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde
PubChem CID118996981
Molecular FormulaC12H8Cl2N2O
Molecular Weight267.12 g/mol
Exact Mass266.00
IUPAC Name2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde
SMILESNc1cc(C=O)c(-c2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C12H8Cl2N2O/c13-8-1-2-9(11(14)4-8)10-5-16-12(15)3-7(10)6-17/h1-6H,(H2,15,16)
InChIKeySVVMAIUAWBVBDH-UHFFFAOYSA-N
XLogP3.45
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.12
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-chloro-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde
CID 119008873
5-chloro-2-(2-methylpyrimidin-5-yl)benzaldehyde
CID 169095205
3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde
CID 133090824
5-chloro-2-(2,4-dichlorophenyl)aniline
CID 70539769
3-(2,4-dichlorophenyl)-1-pyrimidin-2-ylpyrazole-4-carbaldehyde
CID 43531822
2-(2,4-dichlorophenyl)-4-hydroxy-5-methoxybenzaldehyde
CID 22633197
2-amino-5-(2,4,6-trichlorophenyl)pyridine-3-carbaldehyde
CID 119014537
4-chloro-2-(2,4-dichlorophenyl)aniline
CID 81274576
6-amino-5-(2,4-dichlorophenyl)pyridine-3-carboxylic acid
CID 133087190
4-(2,4-dichlorophenyl)-2-formylthieno[2,3-c]pyridine-7-carboxylic acid
CID 18516266
2,4-dichloro-6-(2,4-dichlorophenyl)aniline
CID 71372791
3-(2,4-dichlorophenyl)-4-fluoro-2-hydroxybenzaldehyde
CID 86608680

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde?
The IUPAC name of 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde (CID 118996981) is 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde.
What is the SMILES notation for 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde?
The canonical SMILES for 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde is Nc1cc(C=O)c(-c2ccc(Cl)cc2Cl)cn1.
What is the InChIKey of 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde?
The InChIKey is SVVMAIUAWBVBDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2N2O/c13-8-1-2-9(11(14)4-8)10-5-16-12(15)3-7(10)6-17/h1-6H,(H2,15,16).
What are the key properties of 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde?
2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde has a molecular weight of 267.12 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde is sourced from PubChem (CID 118996981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).