N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide

C11H13BrN2O — CID 102674085

IUPACN-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide
SMILESO=C(CC1CCC1)Nc1cc(Br)ccn1
InChIInChI=1S/C11H13BrN2O/c12-9-4-5-13-10(7-9)14-11(15)6-8-2-1-3-8/h4-5,7-8H,1-3,6H2,(H,13,14,15)
InChIKeyBIAGUHOVCLVWEB-UHFFFAOYSA-N
MW269.14 g/mol
LogP2.97
Rot. Bonds3

About N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide

N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide (PubChem CID 102674085) has the molecular formula C11H13BrN2O and a molecular weight of 269.14 g/mol. Its IUPAC name is N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide.

Molecular Properties

Compound NameN-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide
PubChem CID102674085
Molecular FormulaC11H13BrN2O
Molecular Weight269.14 g/mol
Exact Mass268.02
IUPAC NameN-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide
SMILESO=C(CC1CCC1)Nc1cc(Br)ccn1
InChIInChI=1S/C11H13BrN2O/c12-9-4-5-13-10(7-9)14-11(15)6-8-2-1-3-8/h4-5,7-8H,1-3,6H2,(H,13,14,15)
InChIKeyBIAGUHOVCLVWEB-UHFFFAOYSA-N
XLogP2.97
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.14
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-2-pyridinyl)-4-cyclopentylbutanamide
CID 115274320
N-(4-bromo-2-pyridinyl)cyclopentanecarboxamide
CID 102674366
1-(4-bromo-2-pyridinyl)-3-cyclopentylurea
CID 108902777
N-(5-bromo-2-chlorophenyl)-2-cyclobutylacetamide
CID 103707266
N-(4-chloro-2-pyridinyl)-2-(thian-4-yl)acetamide
CID 115699481
4-bromo-N-(4-bromo-2-pyridinyl)butanamide;ethane
CID 177218315
N-(4-bromo-2-pyridinyl)-4-methylcyclohexane-1-carboxamide
CID 102674384
1-(4-bromo-2-pyridinyl)-3-(oxan-4-ylmethyl)urea
CID 108913036
N-(4-bromo-2,6-dimethylphenyl)-2-cyclobutylacetamide
CID 103714250
N-(2-amino-4-bromophenyl)-2-cyclohexylacetamide
CID 43130499
N-(2-chloropyrimidin-4-yl)-2-cyclohexylacetamide
CID 116798496
N-(4-bromo-2-fluorophenyl)-2-cycloheptylacetamide
CID 114457942

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide?
The IUPAC name of N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide (CID 102674085) is N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide.
What is the SMILES notation for N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide?
The canonical SMILES for N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide is O=C(CC1CCC1)Nc1cc(Br)ccn1.
What is the InChIKey of N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide?
The InChIKey is BIAGUHOVCLVWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2O/c12-9-4-5-13-10(7-9)14-11(15)6-8-2-1-3-8/h4-5,7-8H,1-3,6H2,(H,13,14,15).
What are the key properties of N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide?
N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide has a molecular weight of 269.14 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide is sourced from PubChem (CID 102674085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).