1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid

C11H17NO3 — CID 81158706

IUPAC1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCC1)C1CCCC1
InChIInChI=1S/C11H17NO3/c13-9(8-4-1-2-5-8)12-11(10(14)15)6-3-7-11/h8H,1-7H2,(H,12,13)(H,14,15)
InChIKeySDXOHWQTKMKBBA-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.30
Rot. Bonds3

About 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid

1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid (PubChem CID 81158706) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid.

Molecular Properties

Compound Name1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid
PubChem CID81158706
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCC1)C1CCCC1
InChIInChI=1S/C11H17NO3/c13-9(8-4-1-2-5-8)12-11(10(14)15)6-3-7-11/h8H,1-7H2,(H,12,13)(H,14,15)
InChIKeySDXOHWQTKMKBBA-UHFFFAOYSA-N
XLogP1.30
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid?
The IUPAC name of 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid (CID 81158706) is 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid.
What is the SMILES notation for 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid?
The canonical SMILES for 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid is O=C(NC1(C(=O)O)CCC1)C1CCCC1.
What is the InChIKey of 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid?
The InChIKey is SDXOHWQTKMKBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c13-9(8-4-1-2-5-8)12-11(10(14)15)6-3-7-11/h8H,1-7H2,(H,12,13)(H,14,15).
What are the key properties of 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid?
1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid has a molecular weight of 211.26 g/mol, XLogP of 1.30, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid is sourced from PubChem (CID 81158706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).