N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide

C11H14BrN3O — CID 103161641

IUPACN-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide
SMILESNc1cnc(NC(=O)CC2CCC2)c(Br)c1
InChIInChI=1S/C11H14BrN3O/c12-9-5-8(13)6-14-11(9)15-10(16)4-7-2-1-3-7/h5-7H,1-4,13H2,(H,14,15,16)
InChIKeyPSBJWQSTULGWHM-UHFFFAOYSA-N
MW284.16 g/mol
LogP2.56
Rot. Bonds3

About N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide

N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide (PubChem CID 103161641) has the molecular formula C11H14BrN3O and a molecular weight of 284.16 g/mol. Its IUPAC name is N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide.

Molecular Properties

Compound NameN-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide
PubChem CID103161641
Molecular FormulaC11H14BrN3O
Molecular Weight284.16 g/mol
Exact Mass283.03
IUPAC NameN-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide
SMILESNc1cnc(NC(=O)CC2CCC2)c(Br)c1
InChIInChI=1S/C11H14BrN3O/c12-9-5-8(13)6-14-11(9)15-10(16)4-7-2-1-3-7/h5-7H,1-4,13H2,(H,14,15,16)
InChIKeyPSBJWQSTULGWHM-UHFFFAOYSA-N
XLogP2.56
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.16
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-2-N-cyclobutylpyridine-2,5-diamine
CID 79535634
N-(5-amino-3-bromo-2-pyridinyl)-4,4-dimethylpentanamide
CID 114212725
3-(5-amino-3-bromo-2-pyridinyl)-1-ethyl-1-methylurea
CID 79160095
N-(5-amino-3-bromo-2-pyridinyl)-4-methylpiperidine-1-carboxamide
CID 79160185
N-(4-bromo-2-pyridinyl)-2-cyclobutylacetamide
CID 102674085
N-(5-amino-3-bromo-2-pyridinyl)-2,4-dibromobenzamide
CID 107937535
3-bromo-2-N-(oxan-3-ylmethyl)pyridine-2,5-diamine
CID 79535173
N-(5-amino-3-bromo-2-pyridinyl)-5-methyloxolane-3-carboxamide
CID 114824269
N-(5-amino-3-bromo-2-pyridinyl)-3-ethylthiophene-2-carboxamide
CID 79985523
N-(4-bromo-2,6-dimethylphenyl)-2-cyclobutylacetamide
CID 103714250
1-(4-amino-2-bromophenyl)-2-cyclobutylethanone
CID 103167069
4-[(5-amino-3-bromo-2-pyridinyl)amino]cyclohexan-1-ol
CID 79531530

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide?
The IUPAC name of N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide (CID 103161641) is N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide.
What is the SMILES notation for N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide?
The canonical SMILES for N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide is Nc1cnc(NC(=O)CC2CCC2)c(Br)c1.
What is the InChIKey of N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide?
The InChIKey is PSBJWQSTULGWHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3O/c12-9-5-8(13)6-14-11(9)15-10(16)4-7-2-1-3-7/h5-7H,1-4,13H2,(H,14,15,16).
What are the key properties of N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide?
N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide has a molecular weight of 284.16 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-3-bromo-2-pyridinyl)-2-cyclobutylacetamide is sourced from PubChem (CID 103161641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).