N-(6-anilino-3-pyridinyl)-3-phenylpropanamide

C20H19N3O — CID 113016040

IUPACN-(6-anilino-3-pyridinyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C20H19N3O/c24-20(14-11-16-7-3-1-4-8-16)23-18-12-13-19(21-15-18)22-17-9-5-2-6-10-17/h1-10,12-13,15H,11,14H2,(H,21,22)(H,23,24)
InChIKeyHBUWAHVAUPKNIL-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.40
Rot. Bonds6

About N-(6-anilino-3-pyridinyl)-3-phenylpropanamide

N-(6-anilino-3-pyridinyl)-3-phenylpropanamide (PubChem CID 113016040) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(6-anilino-3-pyridinyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(6-anilino-3-pyridinyl)-3-phenylpropanamide
PubChem CID113016040
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC NameN-(6-anilino-3-pyridinyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C20H19N3O/c24-20(14-11-16-7-3-1-4-8-16)23-18-12-13-19(21-15-18)22-17-9-5-2-6-10-17/h1-10,12-13,15H,11,14H2,(H,21,22)(H,23,24)
InChIKeyHBUWAHVAUPKNIL-UHFFFAOYSA-N
XLogP4.40
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(3-acetamidoanilino)-3-pyridinyl]-3-phenylpropanamide
CID 113020496
3-phenyl-N-[6-(4-propan-2-yloxyanilino)-3-pyridinyl]propanamide
CID 113019912
N-[6-(2-methylanilino)-3-pyridinyl]-3-phenylpropanamide
CID 113016114
3-phenyl-N-[5-(2-phenylethylamino)-2-pyridinyl]propanamide
CID 113028011
N-[6-(2,4-dimethylanilino)-3-pyridinyl]-3-phenylpropanamide
CID 113016782
N-(6-anilino-3-pyridinyl)-2-(4-butylphenyl)acetamide
CID 110178545
N-[6-(3-methylbutylamino)-3-pyridinyl]-3-phenylpropanamide
CID 113015098
N-(6-anilino-3-pyridinyl)-2-(3-fluorophenyl)acetamide
CID 113016055
N-[5-[(5-methyl-1,2-oxazol-3-yl)amino]-2-pyridinyl]-3-phenylpropanamide
CID 113037695
3-phenyl-N-[4-(phenylcarbamoylamino)phenyl]propanamide
CID 17233492
3-phenyl-N-[5-(2,3,4-trifluoroanilino)-2-pyridinyl]propanamide
CID 113037437
N-[5-(2-cyanoanilino)-2-pyridinyl]-3-phenylpropanamide
CID 113037072

Frequently Asked Questions

What is the IUPAC name of N-(6-anilino-3-pyridinyl)-3-phenylpropanamide?
The IUPAC name of N-(6-anilino-3-pyridinyl)-3-phenylpropanamide (CID 113016040) is N-(6-anilino-3-pyridinyl)-3-phenylpropanamide.
What is the SMILES notation for N-(6-anilino-3-pyridinyl)-3-phenylpropanamide?
The canonical SMILES for N-(6-anilino-3-pyridinyl)-3-phenylpropanamide is O=C(CCc1ccccc1)Nc1ccc(Nc2ccccc2)nc1.
What is the InChIKey of N-(6-anilino-3-pyridinyl)-3-phenylpropanamide?
The InChIKey is HBUWAHVAUPKNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c24-20(14-11-16-7-3-1-4-8-16)23-18-12-13-19(21-15-18)22-17-9-5-2-6-10-17/h1-10,12-13,15H,11,14H2,(H,21,22)(H,23,24).
What are the key properties of N-(6-anilino-3-pyridinyl)-3-phenylpropanamide?
N-(6-anilino-3-pyridinyl)-3-phenylpropanamide has a molecular weight of 317.39 g/mol, XLogP of 4.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-anilino-3-pyridinyl)-3-phenylpropanamide is sourced from PubChem (CID 113016040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).