N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide

C18H13Cl2N3O — CID 143380111

IUPACN-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide
SMILESO=CNNc1cc(-c2ccc(Cl)cc2)c(-c2ccccc2Cl)cn1
InChIInChI=1S/C18H13Cl2N3O/c19-13-7-5-12(6-8-13)15-9-18(23-22-11-24)21-10-16(15)14-3-1-2-4-17(14)20/h1-11H,(H,21,23)(H,22,24)
InChIKeyVLEVZCSDQRUZAE-UHFFFAOYSA-N
MW358.23 g/mol
LogP4.80
Rot. Bonds5

About N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide

N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide (PubChem CID 143380111) has the molecular formula C18H13Cl2N3O and a molecular weight of 358.23 g/mol. Its IUPAC name is N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide.

Molecular Properties

Compound NameN-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide
PubChem CID143380111
Molecular FormulaC18H13Cl2N3O
Molecular Weight358.23 g/mol
Exact Mass357.04
IUPAC NameN-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide
SMILESO=CNNc1cc(-c2ccc(Cl)cc2)c(-c2ccccc2Cl)cn1
InChIInChI=1S/C18H13Cl2N3O/c19-13-7-5-12(6-8-13)15-9-18(23-22-11-24)21-10-16(15)14-3-1-2-4-17(14)20/h1-11H,(H,21,23)(H,22,24)
InChIKeyVLEVZCSDQRUZAE-UHFFFAOYSA-N
XLogP4.80
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.23
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[[5-(2-chlorophenyl)-1H-pyrazol-3-yl]amino]formamide
CID 174791254
4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine
CID 143379985
1-chloro-2-(4-chlorophenyl)benzene;dichloromethane
CID 175257983
3-(2-chlorophenyl)-6-(4-chlorophenyl)-1,2,4,5-tetrazine
CID 849920
1-chloro-2-[2-[2-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
CID 171525544
N-[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]-2-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]acetohydrazide
CID 68690859
N-[[5-(4-chlorophenyl)-4-pyridin-4-ylpyridazin-3-yl]amino]formamide
CID 143072017
2,5-dichloro-3-(2-chlorophenyl)pyridine
CID 90014115
6-(2-chlorophenyl)-7-(4-chlorophenyl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 143380056
diethyl 2-(2-chlorophenyl)-5-(4-chlorophenyl)benzene-1,4-dicarboxylate
CID 138461804
2-(2-chlorophenyl)-3-(2-phenylphenyl)naphthalene
CID 171525540
1-chloro-4-(4-chlorophenyl)-2-phenylbenzene
CID 18410681

Frequently Asked Questions

What is the IUPAC name of N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide?
The IUPAC name of N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide (CID 143380111) is N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide.
What is the SMILES notation for N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide?
The canonical SMILES for N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide is O=CNNc1cc(-c2ccc(Cl)cc2)c(-c2ccccc2Cl)cn1.
What is the InChIKey of N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide?
The InChIKey is VLEVZCSDQRUZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N3O/c19-13-7-5-12(6-8-13)15-9-18(23-22-11-24)21-10-16(15)14-3-1-2-4-17(14)20/h1-11H,(H,21,23)(H,22,24).
What are the key properties of N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide?
N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide has a molecular weight of 358.23 g/mol, XLogP of 4.80, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide is sourced from PubChem (CID 143380111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).