HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program：[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-[(Cyclopentylcarbonyl)amino]butanoic acid

HCID 21991259
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCC(NC(=O)C1CCCC1)C(=O)O
InChIKey
VBFIQRYHLRVKBT-UHFFFAOYSA-N
Molecular formula
C10H17NO3
Average molar mass
199.25 g/mol
Monoisotopic mass
199.1208434

Names & identifiers

Preferred name
2-[(Cyclopentylcarbonyl)amino]butanoic acid
IUPAC
2-(cyclopentanecarbonylamino)butanoic acid

Names & synonyms

2-[(Cyclopentylcarbonyl)amino]butanoic acidSCHEMBL5730708VBFIQRYHLRVKBT-UHFFFAOYSA-NAKOS008985862252678-53-8DB-392233

Database identifiers

PubChem CID
21991259

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
66.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
221

Related reactions

6 records
New reaction record
HRID 7548 reaction equation
HRID 7548As productuspto-grants-2006_08
HRID 7549 reaction equation
HRID 7549As reactantuspto-grants-2006_08
HRID 293101 reaction equation
HRID 293101As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1538660 reaction equation
HRID 1538660As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1791180 reaction equation
HRID 1791180As productuspto-grants-2006_07
HRID 1791181 reaction equation
HRID 1791181As reactantuspto-grants-2006_07

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes