4-(3,5-dimethyl-4-pyridinyl)butanamide

C11H16N2O — CID 173252398

IUPAC4-(3,5-dimethyl-4-pyridinyl)butanamide
SMILESCc1cncc(C)c1CCCC(N)=O
InChIInChI=1S/C11H16N2O/c1-8-6-13-7-9(2)10(8)4-3-5-11(12)14/h6-7H,3-5H2,1-2H3,(H2,12,14)
InChIKeyQUSDOFDYBSIFQB-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.51
Rot. Bonds4

About 4-(3,5-dimethyl-4-pyridinyl)butanamide

4-(3,5-dimethyl-4-pyridinyl)butanamide (PubChem CID 173252398) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 4-(3,5-dimethyl-4-pyridinyl)butanamide.

Molecular Properties

Compound Name4-(3,5-dimethyl-4-pyridinyl)butanamide
PubChem CID173252398
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name4-(3,5-dimethyl-4-pyridinyl)butanamide
SMILESCc1cncc(C)c1CCCC(N)=O
InChIInChI=1S/C11H16N2O/c1-8-6-13-7-9(2)10(8)4-3-5-11(12)14/h6-7H,3-5H2,1-2H3,(H2,12,14)
InChIKeyQUSDOFDYBSIFQB-UHFFFAOYSA-N
XLogP1.51
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-hydroxy-5-methyl-4-pyridinyl)butanoic acid
CID 67825011
4-(2-methylphenyl)butanamide
CID 22103596
3-(3,5-dimethyl-4-pyridinyl)butanamide
CID 173252399
4-(1,3-thiazol-5-yl)butanamide
CID 66579232
18-[2-(18-amino-18-oxooctadecyl)-3,6-dimethylphenyl]octadecanoic acid
CID 69051285
4-(2-cyano-6-methylphenyl)butanamide
CID 173253243
4-(2H-triazol-4-yl)butanamide
CID 90219359
3-pyrimidin-5-ylpropanamide
CID 91363418
7-(2-methyl-1H-imidazol-5-yl)heptanamide
CID 173264947
4-(6-methylpyrazin-2-yl)but-3-enamide
CID 170797338
4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide
CID 123973953
3-(2-amino-4-hydroxy-6-methylphenyl)propanamide
CID 142306659

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethyl-4-pyridinyl)butanamide?
The IUPAC name of 4-(3,5-dimethyl-4-pyridinyl)butanamide (CID 173252398) is 4-(3,5-dimethyl-4-pyridinyl)butanamide.
What is the SMILES notation for 4-(3,5-dimethyl-4-pyridinyl)butanamide?
The canonical SMILES for 4-(3,5-dimethyl-4-pyridinyl)butanamide is Cc1cncc(C)c1CCCC(N)=O.
What is the InChIKey of 4-(3,5-dimethyl-4-pyridinyl)butanamide?
The InChIKey is QUSDOFDYBSIFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8-6-13-7-9(2)10(8)4-3-5-11(12)14/h6-7H,3-5H2,1-2H3,(H2,12,14).
What are the key properties of 4-(3,5-dimethyl-4-pyridinyl)butanamide?
4-(3,5-dimethyl-4-pyridinyl)butanamide has a molecular weight of 192.26 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethyl-4-pyridinyl)butanamide is sourced from PubChem (CID 173252398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).