N-[5-(4-methylanilino)-2-pyridinyl]propanamide

C15H17N3O — CID 113031521

IUPACN-[5-(4-methylanilino)-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(Nc2ccc(C)cc2)cn1
InChIInChI=1S/C15H17N3O/c1-3-15(19)18-14-9-8-13(10-16-14)17-12-6-4-11(2)5-7-12/h4-10,17H,3H2,1-2H3,(H,16,18,19)
InChIKeyGDBDKDZAOJBECE-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.48
Rot. Bonds4

About N-[5-(4-methylanilino)-2-pyridinyl]propanamide

N-[5-(4-methylanilino)-2-pyridinyl]propanamide (PubChem CID 113031521) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[5-(4-methylanilino)-2-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[5-(4-methylanilino)-2-pyridinyl]propanamide
PubChem CID113031521
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-[5-(4-methylanilino)-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(Nc2ccc(C)cc2)cn1
InChIInChI=1S/C15H17N3O/c1-3-15(19)18-14-9-8-13(10-16-14)17-12-6-4-11(2)5-7-12/h4-10,17H,3H2,1-2H3,(H,16,18,19)
InChIKeyGDBDKDZAOJBECE-UHFFFAOYSA-N
XLogP3.48
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromophenyl)-N-[5-(4-methylanilino)-2-pyridinyl]acetamide
CID 113031585
N-[5-(propylamino)-2-pyridinyl]propanamide
CID 113023412
N-[6-(4-fluoroanilino)-3-pyridinyl]propanamide
CID 113018289
2-methyl-N-[5-(4-methylanilino)-2-pyridinyl]benzamide
CID 113031534
N-[5-(3,4,5-trimethoxyanilino)-2-pyridinyl]propanamide
CID 113036500
N-[5-(2-chloroanilino)-2-pyridinyl]propanamide
CID 113033183
2,2-dimethyl-N-[6-(propanoylamino)-3-pyridinyl]propanamide
CID 1452729
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
CID 113026477
N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide
CID 113019477
N-(5-anilino-2-pyridinyl)pentanamide
CID 113031172
N-[5-(2,5-dichloroanilino)-2-pyridinyl]propanamide
CID 113036750
N-[5-(4-methylanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113031564

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-methylanilino)-2-pyridinyl]propanamide?
The IUPAC name of N-[5-(4-methylanilino)-2-pyridinyl]propanamide (CID 113031521) is N-[5-(4-methylanilino)-2-pyridinyl]propanamide.
What is the SMILES notation for N-[5-(4-methylanilino)-2-pyridinyl]propanamide?
The canonical SMILES for N-[5-(4-methylanilino)-2-pyridinyl]propanamide is CCC(=O)Nc1ccc(Nc2ccc(C)cc2)cn1.
What is the InChIKey of N-[5-(4-methylanilino)-2-pyridinyl]propanamide?
The InChIKey is GDBDKDZAOJBECE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-3-15(19)18-14-9-8-13(10-16-14)17-12-6-4-11(2)5-7-12/h4-10,17H,3H2,1-2H3,(H,16,18,19).
What are the key properties of N-[5-(4-methylanilino)-2-pyridinyl]propanamide?
N-[5-(4-methylanilino)-2-pyridinyl]propanamide has a molecular weight of 255.32 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-methylanilino)-2-pyridinyl]propanamide is sourced from PubChem (CID 113031521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).