N-(5-bromo-6-methyl-2-pyridinyl)pentanamide

C11H15BrN2O — CID 2996808

IUPACN-(5-bromo-6-methyl-2-pyridinyl)pentanamide
SMILESCCCCC(=O)Nc1ccc(Br)c(C)n1
InChIInChI=1S/C11H15BrN2O/c1-3-4-5-11(15)14-10-7-6-9(12)8(2)13-10/h6-7H,3-5H2,1-2H3,(H,13,14,15)
InChIKeyOTQCFCGBAJHWFX-UHFFFAOYSA-N
MW271.16 g/mol
LogP3.28
Rot. Bonds4

About N-(5-bromo-6-methyl-2-pyridinyl)pentanamide

N-(5-bromo-6-methyl-2-pyridinyl)pentanamide (PubChem CID 2996808) has the molecular formula C11H15BrN2O and a molecular weight of 271.16 g/mol. Its IUPAC name is N-(5-bromo-6-methyl-2-pyridinyl)pentanamide.

Molecular Properties

Compound NameN-(5-bromo-6-methyl-2-pyridinyl)pentanamide
PubChem CID2996808
Molecular FormulaC11H15BrN2O
Molecular Weight271.16 g/mol
Exact Mass270.04
IUPAC NameN-(5-bromo-6-methyl-2-pyridinyl)pentanamide
SMILESCCCCC(=O)Nc1ccc(Br)c(C)n1
InChIInChI=1S/C11H15BrN2O/c1-3-4-5-11(15)14-10-7-6-9(12)8(2)13-10/h6-7H,3-5H2,1-2H3,(H,13,14,15)
InChIKeyOTQCFCGBAJHWFX-UHFFFAOYSA-N
XLogP3.28
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)pentanamide?
The IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)pentanamide (CID 2996808) is N-(5-bromo-6-methyl-2-pyridinyl)pentanamide.
What is the SMILES notation for N-(5-bromo-6-methyl-2-pyridinyl)pentanamide?
The canonical SMILES for N-(5-bromo-6-methyl-2-pyridinyl)pentanamide is CCCCC(=O)Nc1ccc(Br)c(C)n1.
What is the InChIKey of N-(5-bromo-6-methyl-2-pyridinyl)pentanamide?
The InChIKey is OTQCFCGBAJHWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O/c1-3-4-5-11(15)14-10-7-6-9(12)8(2)13-10/h6-7H,3-5H2,1-2H3,(H,13,14,15).
What are the key properties of N-(5-bromo-6-methyl-2-pyridinyl)pentanamide?
N-(5-bromo-6-methyl-2-pyridinyl)pentanamide has a molecular weight of 271.16 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-6-methyl-2-pyridinyl)pentanamide is sourced from PubChem (CID 2996808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).