(2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide

C13H17BrN2O2 — CID 8891311

IUPAC(2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide
SMILESC[C@@H](C(=O)NC1CCCC1)n1cc(Br)ccc1=O
InChIInChI=1S/C13H17BrN2O2/c1-9(13(18)15-11-4-2-3-5-11)16-8-10(14)6-7-12(16)17/h6-9,11H,2-5H2,1H3,(H,15,18)/t9-/m0/s1
InChIKeyVIEKUDIHXUETCU-VIFPVBQESA-N
MW313.19 g/mol
LogP2.23
Rot. Bonds3

About (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide

(2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide (PubChem CID 8891311) has the molecular formula C13H17BrN2O2 and a molecular weight of 313.19 g/mol. Its IUPAC name is (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide.

Molecular Properties

Compound Name(2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide
PubChem CID8891311
Molecular FormulaC13H17BrN2O2
Molecular Weight313.19 g/mol
Exact Mass312.05
IUPAC Name(2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide
SMILESC[C@@H](C(=O)NC1CCCC1)n1cc(Br)ccc1=O
InChIInChI=1S/C13H17BrN2O2/c1-9(13(18)15-11-4-2-3-5-11)16-8-10(14)6-7-12(16)17/h6-9,11H,2-5H2,1H3,(H,15,18)/t9-/m0/s1
InChIKeyVIEKUDIHXUETCU-VIFPVBQESA-N
XLogP2.23
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.19
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromopyrazol-1-yl)-N-cyclooctylpropanamide
CID 154834581
(2R)-2-(4-bromoanilino)-N-cyclopentylpropanamide
CID 8005833
5-bromo-1-[1-[1-(cyclobutylmethyl)-2,5-dimethylpyrrol-3-yl]-1-oxopropan-2-yl]pyridin-2-one
CID 139467221
4-[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]-N-cyclohexylpiperazine-1-carboxamide
CID 55637875
2-(5-bromo-2-oxo-1-pyridinyl)-N-[(1R,2R)-2-hydroxycyclohexyl]acetamide
CID 94414346
2-(4-bromo-3-methylpyrazol-1-yl)-N-cyclooctylpropanamide
CID 45125859
5-bromo-1-(1-fluoropropan-2-yl)pyridin-2-one
CID 58070322
N-cyclopentyl-2-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]propanamide
CID 79411085
2-[(6-bromoquinazolin-4-yl)amino]-N-cyclopentylpropanamide
CID 175431192
2-(4-chloro-6-oxopyrimidin-1-yl)-N-cyclopropylpropanamide
CID 114582349
(2S)-2-[(4-bromophenyl)sulfonylamino]-N-cyclopentylpropanamide
CID 40746707
1-[1-(cyclopentylamino)-1-oxopropan-2-yl]-2-ethylimidazole-4-sulfonyl chloride
CID 82911787

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide?
The IUPAC name of (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide (CID 8891311) is (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide.
What is the SMILES notation for (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide?
The canonical SMILES for (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide is C[C@@H](C(=O)NC1CCCC1)n1cc(Br)ccc1=O.
What is the InChIKey of (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide?
The InChIKey is VIEKUDIHXUETCU-VIFPVBQESA-N. The full InChI is InChI=1S/C13H17BrN2O2/c1-9(13(18)15-11-4-2-3-5-11)16-8-10(14)6-7-12(16)17/h6-9,11H,2-5H2,1H3,(H,15,18)/t9-/m0/s1.
What are the key properties of (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide?
(2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide has a molecular weight of 313.19 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(5-bromo-2-oxo-1-pyridinyl)-N-cyclopentylpropanamide is sourced from PubChem (CID 8891311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).