N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide

C21H20N2O — CID 59093479

IUPACN-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide
SMILESCC(CNC(=O)c1ccncc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H20N2O/c1-16(15-23-21(24)20-11-13-22-14-12-20)17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,16H,15H2,1H3,(H,23,24)
InChIKeyYYZFVSXMRAECRU-UHFFFAOYSA-N
MW316.40 g/mol
LogP4.28
Rot. Bonds5

About N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide

N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide (PubChem CID 59093479) has the molecular formula C21H20N2O and a molecular weight of 316.40 g/mol. Its IUPAC name is N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide
PubChem CID59093479
Molecular FormulaC21H20N2O
Molecular Weight316.40 g/mol
Exact Mass316.16
IUPAC NameN-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide
SMILESCC(CNC(=O)c1ccncc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H20N2O/c1-16(15-23-21(24)20-11-13-22-14-12-20)17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,16H,15H2,1H3,(H,23,24)
InChIKeyYYZFVSXMRAECRU-UHFFFAOYSA-N
XLogP4.28
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-[(2R)-2-phenylpropyl]benzamide
CID 9302175
N-(2-phenylpropyl)pyridine-3-carboxamide
CID 46446505
N-(2-methylpropyl)-4-(4-phenylphenyl)benzamide
CID 145125410
N-(2-hydroxypropyl)-4-phenylbenzamide
CID 43391038
N-[(2R)-2-(dimethylamino)-2-phenylethyl]pyridine-4-carboxamide
CID 32730765
2-chloro-N-(2-phenylpropyl)pyridine-4-carboxamide
CID 46520684
bicyclo[2.2.0]hexa-1,3,5-triene;N-(2-phenylpropyl)acetamide
CID 175348879
4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide
CID 3732499
1-oxido-N-(2-phenylpropyl)pyridin-1-ium-4-carboxamide
CID 47098870
N-(3-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 65031932
N-[2-benzamido-2-(4-phenylphenyl)ethyl]benzamide
CID 139256665
N-(3-chloro-2-methylpropyl)pyridine-4-carboxamide
CID 114302740

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide?
The IUPAC name of N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide (CID 59093479) is N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide?
The canonical SMILES for N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide is CC(CNC(=O)c1ccncc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide?
The InChIKey is YYZFVSXMRAECRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O/c1-16(15-23-21(24)20-11-13-22-14-12-20)17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,16H,15H2,1H3,(H,23,24).
What are the key properties of N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide?
N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide has a molecular weight of 316.40 g/mol, XLogP of 4.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide is sourced from PubChem (CID 59093479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).