N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide

C18H23N3O — CID 113017248

IUPACN-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(Nc2cccc(C)c2C)nc1
InChIInChI=1S/C18H23N3O/c1-4-5-9-18(22)20-15-10-11-17(19-12-15)21-16-8-6-7-13(2)14(16)3/h6-8,10-12H,4-5,9H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyWPMVZOHLBORACS-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.57
Rot. Bonds6

About N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide

N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide (PubChem CID 113017248) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide.

Molecular Properties

Compound NameN-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide
PubChem CID113017248
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC NameN-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(Nc2cccc(C)c2C)nc1
InChIInChI=1S/C18H23N3O/c1-4-5-9-18(22)20-15-10-11-17(19-12-15)21-16-8-6-7-13(2)14(16)3/h6-8,10-12H,4-5,9H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyWPMVZOHLBORACS-UHFFFAOYSA-N
XLogP4.57
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(pentanoylamino)-3-pyridinyl]pentanamide
CID 649725
N-[6-(4-chloro-2-methylanilino)-3-pyridinyl]pentanamide
CID 113018819
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
CID 113017295
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 113017290
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113017296
N-[6-(2-methylanilino)-3-pyridinyl]-3-phenylpropanamide
CID 113016114
N-[6-(3,4-dichloroanilino)-3-pyridinyl]pentanamide
CID 113022156
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(1H-indol-3-yl)acetamide
CID 113017273
N-[5-(2-chloroanilino)-2-pyridinyl]pentanamide
CID 113033187
N-(5-anilino-2-pyridinyl)pentanamide
CID 113031172
N-(2,3-dimethylphenyl)dodecanamide
CID 4198682
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-4-methoxybenzamide
CID 113017268

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide?
The IUPAC name of N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide (CID 113017248) is N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide.
What is the SMILES notation for N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide?
The canonical SMILES for N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide is CCCCC(=O)Nc1ccc(Nc2cccc(C)c2C)nc1.
What is the InChIKey of N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide?
The InChIKey is WPMVZOHLBORACS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-4-5-9-18(22)20-15-10-11-17(19-12-15)21-16-8-6-7-13(2)14(16)3/h6-8,10-12H,4-5,9H2,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide?
N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide has a molecular weight of 297.40 g/mol, XLogP of 4.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,3-dimethylanilino)-3-pyridinyl]pentanamide is sourced from PubChem (CID 113017248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).