N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide

C12H8Cl2N2O — CID 151611576

IUPACN-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide
SMILESO=CNc1ccc(Cl)cc1-c1cccnc1Cl
InChIInChI=1S/C12H8Cl2N2O/c13-8-3-4-11(16-7-17)10(6-8)9-2-1-5-15-12(9)14/h1-7H,(H,16,17)
InChIKeyQMPNHAFVDWWJFI-UHFFFAOYSA-N
MW267.12 g/mol
LogP3.62
Rot. Bonds3

About N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide

N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide (PubChem CID 151611576) has the molecular formula C12H8Cl2N2O and a molecular weight of 267.12 g/mol. Its IUPAC name is N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide.

Molecular Properties

Compound NameN-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide
PubChem CID151611576
Molecular FormulaC12H8Cl2N2O
Molecular Weight267.12 g/mol
Exact Mass266.00
IUPAC NameN-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide
SMILESO=CNc1ccc(Cl)cc1-c1cccnc1Cl
InChIInChI=1S/C12H8Cl2N2O/c13-8-3-4-11(16-7-17)10(6-8)9-2-1-5-15-12(9)14/h1-7H,(H,16,17)
InChIKeyQMPNHAFVDWWJFI-UHFFFAOYSA-N
XLogP3.62
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.12
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(2-chloro-3-pyridinyl)-hydroxymethyl]phenyl]formamide
CID 102126964
2-chloro-3-(2-fluorophenyl)pyridine
CID 46312040
N-[4-chloro-2-[(Z)-N-hydroxy-C-phenylcarbonimidoyl]phenyl]formamide
CID 6522385
N-(2-bromo-4-chlorophenyl)-2-chloropyridine-3-carboxamide
CID 81027409
2-bromo-5-chloro-N-(2-chloro-3-pyridinyl)benzamide
CID 113235199
N-[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]formamide
CID 123784450
2-chloro-3-(2,5-dichlorophenyl)pyridine-4-carbaldehyde
CID 119012819
4-chloro-2-formamidobenzoic acid
CID 61146469
2,4-dichloro-N-(2-chloro-3-pyridinyl)benzamide
CID 3454315
7-chloro-6-(2,4-dichloroanilino)quinoline-5,8-dione
CID 71346097
N-(6-methylquinolin-7-yl)formamide
CID 168651780
2-chloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-sulfonamide
CID 43388263

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide?
The IUPAC name of N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide (CID 151611576) is N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide.
What is the SMILES notation for N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide?
The canonical SMILES for N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide is O=CNc1ccc(Cl)cc1-c1cccnc1Cl.
What is the InChIKey of N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide?
The InChIKey is QMPNHAFVDWWJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2N2O/c13-8-3-4-11(16-7-17)10(6-8)9-2-1-5-15-12(9)14/h1-7H,(H,16,17).
What are the key properties of N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide?
N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide has a molecular weight of 267.12 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide is sourced from PubChem (CID 151611576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).