(2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone

C11H13BrN2O — CID 59699866

IUPAC(2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone
SMILESNc1ncc(Br)cc1C(=O)C1CCCC1
InChIInChI=1S/C11H13BrN2O/c12-8-5-9(11(13)14-6-8)10(15)7-3-1-2-4-7/h5-7H,1-4H2,(H2,13,14)
InChIKeyNFDGYBWCYAXOQE-UHFFFAOYSA-N
MW269.14 g/mol
LogP2.80
Rot. Bonds2

About (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone

(2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone (PubChem CID 59699866) has the molecular formula C11H13BrN2O and a molecular weight of 269.14 g/mol. Its IUPAC name is (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone.

Molecular Properties

Compound Name(2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone
PubChem CID59699866
Molecular FormulaC11H13BrN2O
Molecular Weight269.14 g/mol
Exact Mass268.02
IUPAC Name(2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone
SMILESNc1ncc(Br)cc1C(=O)C1CCCC1
InChIInChI=1S/C11H13BrN2O/c12-8-5-9(11(13)14-6-8)10(15)7-3-1-2-4-7/h5-7H,1-4H2,(H2,13,14)
InChIKeyNFDGYBWCYAXOQE-UHFFFAOYSA-N
XLogP2.80
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.14
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-5-bromo-N-cyclopentylpyridine-3-carboxamide
CID 62155023
(2-amino-5-bromo-3-pyridinyl)-[(2S,6R)-2,6-dimethylpiperidin-1-yl]methanone
CID 104968760
(2-amino-5-bromophenyl)-cyclopentylmethanone
CID 66998843
2-amino-5-bromo-N-(2-hydroxycyclohexyl)pyridine-3-carboxamide
CID 62359305
2-amino-5-bromo-N-cycloheptyl-N-methylpyridine-3-carboxamide
CID 55042078
(5-bromo-2-chloro-3-pyridinyl)-cyclopropylmethanone
CID 119054666
2-amino-5-bromo-N-cyclopentyl-N-ethylpyridine-3-carboxamide
CID 62153959
(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-cyclooctylmethanone
CID 106884881
(2-amino-4-bromophenyl)-cyclopentylmethanone
CID 116591688
2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 62187031
2-amino-1-(2-amino-5-bromo-3-pyridinyl)propan-1-one
CID 84704280
[amino-(2-amino-5-bromo-3-pyridinyl)methylidene]azanium
CID 147829128

Frequently Asked Questions

What is the IUPAC name of (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone?
The IUPAC name of (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone (CID 59699866) is (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone.
What is the SMILES notation for (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone?
The canonical SMILES for (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone is Nc1ncc(Br)cc1C(=O)C1CCCC1.
What is the InChIKey of (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone?
The InChIKey is NFDGYBWCYAXOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2O/c12-8-5-9(11(13)14-6-8)10(15)7-3-1-2-4-7/h5-7H,1-4H2,(H2,13,14).
What are the key properties of (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone?
(2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone has a molecular weight of 269.14 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone is sourced from PubChem (CID 59699866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).