N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide

C17H19N3O2 — CID 110175696

IUPACN-[6-(N-propanoylanilino)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(N(C(=O)CC)c2ccccc2)nc1
InChIInChI=1S/C17H19N3O2/c1-3-16(21)19-13-10-11-15(18-12-13)20(17(22)4-2)14-8-6-5-7-9-14/h5-12H,3-4H2,1-2H3,(H,19,21)
InChIKeyWKTWJXXWVGTWDM-UHFFFAOYSA-N
MW297.36 g/mol
LogP3.50
Rot. Bonds5

About N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide

N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide (PubChem CID 110175696) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[6-(N-propanoylanilino)-3-pyridinyl]propanamide
PubChem CID110175696
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-[6-(N-propanoylanilino)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(N(C(=O)CC)c2ccccc2)nc1
InChIInChI=1S/C17H19N3O2/c1-3-16(21)19-13-10-11-15(18-12-13)20(17(22)4-2)14-8-6-5-7-9-14/h5-12H,3-4H2,1-2H3,(H,19,21)
InChIKeyWKTWJXXWVGTWDM-UHFFFAOYSA-N
XLogP3.50
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenylpyrimidin-5-yl)propanamide
CID 53014772
N-[6-(benzylamino)-3-pyridinyl]propanamide
CID 110178661
2-(4-bromophenyl)-N-[6-(N-methylanilino)-3-pyridinyl]acetamide
CID 113016501
2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide
CID 113017550
N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113016495
N-[6-[(1,1-dioxothiolan-3-yl)-methylamino]-3-pyridinyl]propanamide
CID 113013662
(3S)-3-(carbamoylamino)-N-[6-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide
CID 94017927
2-amino-N-[6-[benzyl(ethyl)amino]-3-pyridinyl]acetamide
CID 39181885
N-[6-[butyl(methyl)amino]-3-pyridinyl]-2-phenylacetamide
CID 113015350
N-[5-(propylamino)-2-pyridinyl]propanamide
CID 113023412
N-[6-[6-[5-(propanoylamino)-2-pyridinyl]-1,2,4,5-tetrazin-3-yl]-3-pyridinyl]propanamide
CID 160672212
N-[5-(phenylcarbamoylamino)-2-pyridinyl]-N-propylacetamide
CID 56688570

Frequently Asked Questions

What is the IUPAC name of N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide?
The IUPAC name of N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide (CID 110175696) is N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide.
What is the SMILES notation for N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide?
The canonical SMILES for N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide is CCC(=O)Nc1ccc(N(C(=O)CC)c2ccccc2)nc1.
What is the InChIKey of N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide?
The InChIKey is WKTWJXXWVGTWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-3-16(21)19-13-10-11-15(18-12-13)20(17(22)4-2)14-8-6-5-7-9-14/h5-12H,3-4H2,1-2H3,(H,19,21).
What are the key properties of N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide?
N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide has a molecular weight of 297.36 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide is sourced from PubChem (CID 110175696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).