2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide

C11H14BrN3O — CID 103821261

IUPAC2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide
SMILESCC(N)(C(=O)Nc1ccc(Br)nc1)C1CC1
InChIInChI=1S/C11H14BrN3O/c1-11(13,7-2-3-7)10(16)15-8-4-5-9(12)14-6-8/h4-7H,2-3,13H2,1H3,(H,15,16)
InChIKeyVFUFGMSUKUCERC-UHFFFAOYSA-N
MW284.16 g/mol
LogP1.91
Rot. Bonds3

About 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide

2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide (PubChem CID 103821261) has the molecular formula C11H14BrN3O and a molecular weight of 284.16 g/mol. Its IUPAC name is 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide.

Molecular Properties

Compound Name2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide
PubChem CID103821261
Molecular FormulaC11H14BrN3O
Molecular Weight284.16 g/mol
Exact Mass283.03
IUPAC Name2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide
SMILESCC(N)(C(=O)Nc1ccc(Br)nc1)C1CC1
InChIInChI=1S/C11H14BrN3O/c1-11(13,7-2-3-7)10(16)15-8-4-5-9(12)14-6-8/h4-7H,2-3,13H2,1H3,(H,15,16)
InChIKeyVFUFGMSUKUCERC-UHFFFAOYSA-N
XLogP1.91
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 ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(4-acetamidophenyl)-2-amino-2-cyclopropylpropanamide
CID 60866095
N-(6-bromo-3-pyridinyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 103885084
N-[4-[(2-amino-2-cyclopropylpropanoyl)amino]phenyl]cyclopropanecarboxamide
CID 61252070
2-amino-2-cyclopropyl-N-(4-propan-2-ylphenyl)propanamide
CID 60866090
2-amino-2-cyclopropyl-N-(4-methoxyphenyl)propanamide
CID 54925277
2-amino-2-cyclopropyl-N-[4-(sulfamoylmethyl)phenyl]propanamide
CID 60867551
N-(6-bromo-3-pyridinyl)-4-(trifluoromethyl)cyclohexane-1-carboxamide
CID 106832051
2-amino-2-cyclopropyl-N-[4-(triazol-2-yl)phenyl]propanamide
CID 60867892
2-amino-2-cyclopropyl-N-(3-hydroxy-4-methylphenyl)propanamide
CID 107701447
2-amino-2-cyclopropyl-N-[4-(2-hydroxyethyl)phenyl]propanamide
CID 61237343
2-amino-2-cyclopropyl-N-(4-fluoro-3-methylphenyl)propanamide
CID 55118792
(2R,5S)-5-[(6-bromo-3-pyridinyl)carbamoyl]oxolane-2-carboxylic acid
CID 114051447

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide?
The IUPAC name of 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide (CID 103821261) is 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide.
What is the SMILES notation for 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide?
The canonical SMILES for 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide is CC(N)(C(=O)Nc1ccc(Br)nc1)C1CC1.
What is the InChIKey of 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide?
The InChIKey is VFUFGMSUKUCERC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3O/c1-11(13,7-2-3-7)10(16)15-8-4-5-9(12)14-6-8/h4-7H,2-3,13H2,1H3,(H,15,16).
What are the key properties of 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide?
2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide has a molecular weight of 284.16 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(6-bromo-3-pyridinyl)-2-cyclopropylpropanamide is sourced from PubChem (CID 103821261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).