N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide

C18H16Cl2N2O — CID 969798

IUPACN-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)N1CC=C(c2ccccc2)CC1
InChIInChI=1S/C18H16Cl2N2O/c19-16-7-6-15(12-17(16)20)21-18(23)22-10-8-14(9-11-22)13-4-2-1-3-5-13/h1-8,12H,9-11H2,(H,21,23)
InChIKeyJNZZBKHNSTWIRM-UHFFFAOYSA-N
MW347.25 g/mol
LogP5.31
Rot. Bonds2

About N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide

N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 969798) has the molecular formula C18H16Cl2N2O and a molecular weight of 347.25 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID969798
Molecular FormulaC18H16Cl2N2O
Molecular Weight347.25 g/mol
Exact Mass346.06
IUPAC NameN-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)N1CC=C(c2ccccc2)CC1
InChIInChI=1S/C18H16Cl2N2O/c19-16-7-6-15(12-17(16)20)21-18(23)22-10-8-14(9-11-22)13-4-2-1-3-5-13/h1-8,12H,9-11H2,(H,21,23)
InChIKeyJNZZBKHNSTWIRM-UHFFFAOYSA-N
XLogP5.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.25
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide (CID 969798) is N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)N1CC=C(c2ccccc2)CC1.
What is the InChIKey of N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is JNZZBKHNSTWIRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N2O/c19-16-7-6-15(12-17(16)20)21-18(23)22-10-8-14(9-11-22)13-4-2-1-3-5-13/h1-8,12H,9-11H2,(H,21,23).
What are the key properties of N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide?
N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 347.25 g/mol, XLogP of 5.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 969798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).