N-[6-(3-methylanilino)-3-pyridinyl]butanamide

C16H19N3O — CID 113016196

IUPACN-[6-(3-methylanilino)-3-pyridinyl]butanamide
SMILESCCCC(=O)Nc1ccc(Nc2cccc(C)c2)nc1
InChIInChI=1S/C16H19N3O/c1-3-5-16(20)19-14-8-9-15(17-11-14)18-13-7-4-6-12(2)10-13/h4,6-11H,3,5H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyRGADCFBGSLJOSU-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.87
Rot. Bonds5

About N-[6-(3-methylanilino)-3-pyridinyl]butanamide

N-[6-(3-methylanilino)-3-pyridinyl]butanamide (PubChem CID 113016196) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[6-(3-methylanilino)-3-pyridinyl]butanamide.

Molecular Properties

Compound NameN-[6-(3-methylanilino)-3-pyridinyl]butanamide
PubChem CID113016196
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-[6-(3-methylanilino)-3-pyridinyl]butanamide
SMILESCCCC(=O)Nc1ccc(Nc2cccc(C)c2)nc1
InChIInChI=1S/C16H19N3O/c1-3-5-16(20)19-14-8-9-15(17-11-14)18-13-7-4-6-12(2)10-13/h4,6-11H,3,5H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyRGADCFBGSLJOSU-UHFFFAOYSA-N
XLogP3.87
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(3-methylanilino)-3-pyridinyl]-3-oxobutanamide
CID 110179055
2-ethyl-N-[6-(3-methylanilino)-3-pyridinyl]butanamide
CID 113016204
N-[5-(3-bromoanilino)-2-pyridinyl]butanamide
CID 113036004
2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide
CID 113016197
N-[6-(3,4-dimethoxyanilino)-3-pyridinyl]butanamide
CID 113020075
N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113017495
N-[6-(3,4-dichloroanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113022187
methyl 4-[[5-(butanoylamino)-2-pyridinyl]amino]benzoate
CID 113020725
N-[6-[4-chloro-3-(trifluoromethyl)anilino]-3-pyridinyl]butanamide
CID 113022004
N-[6-(3,4-dichloroanilino)-3-pyridinyl]pentanamide
CID 113022156
N-[6-(3-methoxyanilino)-3-pyridinyl]propanamide
CID 113019375
N-[6-(3-acetamidoanilino)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113020511

Frequently Asked Questions

What is the IUPAC name of N-[6-(3-methylanilino)-3-pyridinyl]butanamide?
The IUPAC name of N-[6-(3-methylanilino)-3-pyridinyl]butanamide (CID 113016196) is N-[6-(3-methylanilino)-3-pyridinyl]butanamide.
What is the SMILES notation for N-[6-(3-methylanilino)-3-pyridinyl]butanamide?
The canonical SMILES for N-[6-(3-methylanilino)-3-pyridinyl]butanamide is CCCC(=O)Nc1ccc(Nc2cccc(C)c2)nc1.
What is the InChIKey of N-[6-(3-methylanilino)-3-pyridinyl]butanamide?
The InChIKey is RGADCFBGSLJOSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-5-16(20)19-14-8-9-15(17-11-14)18-13-7-4-6-12(2)10-13/h4,6-11H,3,5H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of N-[6-(3-methylanilino)-3-pyridinyl]butanamide?
N-[6-(3-methylanilino)-3-pyridinyl]butanamide has a molecular weight of 269.35 g/mol, XLogP of 3.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-methylanilino)-3-pyridinyl]butanamide is sourced from PubChem (CID 113016196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).