2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide

C12H16BrN3O — CID 64684559

IUPAC2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide
SMILESNC1(CC(=O)Nc2ccc(Br)cn2)CCCC1
InChIInChI=1S/C12H16BrN3O/c13-9-3-4-10(15-8-9)16-11(17)7-12(14)5-1-2-6-12/h3-4,8H,1-2,5-7,14H2,(H,15,16,17)
InChIKeyQBANUWITDRATDM-UHFFFAOYSA-N
MW298.18 g/mol
LogP2.44
Rot. Bonds3

About 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide

2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide (PubChem CID 64684559) has the molecular formula C12H16BrN3O and a molecular weight of 298.18 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide
PubChem CID64684559
Molecular FormulaC12H16BrN3O
Molecular Weight298.18 g/mol
Exact Mass297.05
IUPAC Name2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide
SMILESNC1(CC(=O)Nc2ccc(Br)cn2)CCCC1
InChIInChI=1S/C12H16BrN3O/c13-9-3-4-10(15-8-9)16-11(17)7-12(14)5-1-2-6-12/h3-4,8H,1-2,5-7,14H2,(H,15,16,17)
InChIKeyQBANUWITDRATDM-UHFFFAOYSA-N
XLogP2.44
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.18
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclopentyl)-N-(5-chloro-2-pyridinyl)acetamide
CID 64684760
2-(1-aminocyclopentyl)-N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 79734126
1-amino-N-(5-bromo-2-pyridinyl)cyclopropane-1-carboxamide
CID 65466775
2-(1-aminocyclohexyl)-N-(5-bromo-3-pyridinyl)acetamide
CID 114222291
1-amino-N-[2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl]-N-methylcyclohexane-1-carboxamide
CID 119875009
2-(1-aminocyclopentyl)-N-pyrimidin-5-ylacetamide
CID 107588451
2-(4-bromophenyl)-N-(5-bromo-2-pyridinyl)acetamide
CID 29260244
2-(1-aminocyclopentyl)-N-(4-bromo-2-cyanophenyl)acetamide
CID 82708203
2-[[2-(1-aminocyclopentyl)acetyl]amino]-3,5-dibromobenzoic acid
CID 64676657
(3S)-3-amino-N-(5-bromo-2-pyridinyl)-4-hydroxybutanamide
CID 130348311
N-(5-bromo-2-pyridinyl)-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
CID 115305446
1-[(5-bromo-2-pyridinyl)methyl]cyclohexan-1-amine
CID 104802724

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide (CID 64684559) is 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide is NC1(CC(=O)Nc2ccc(Br)cn2)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide?
The InChIKey is QBANUWITDRATDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrN3O/c13-9-3-4-10(15-8-9)16-11(17)7-12(14)5-1-2-6-12/h3-4,8H,1-2,5-7,14H2,(H,15,16,17).
What are the key properties of 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide?
2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide has a molecular weight of 298.18 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-(5-bromo-2-pyridinyl)acetamide is sourced from PubChem (CID 64684559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).