N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide

C13H20N2O2 — CID 53016353

IUPACN-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide
SMILESO=C(NC1CCN(C(=O)C2CC2)C1)C1CCC1
InChIInChI=1S/C13H20N2O2/c16-12(9-2-1-3-9)14-11-6-7-15(8-11)13(17)10-4-5-10/h9-11H,1-8H2,(H,14,16)
InChIKeyGPYLNPSLJRHMFA-UHFFFAOYSA-N
MW236.31 g/mol
LogP0.91
Rot. Bonds3

About N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide

N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide (PubChem CID 53016353) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide
PubChem CID53016353
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide
SMILESO=C(NC1CCN(C(=O)C2CC2)C1)C1CCC1
InChIInChI=1S/C13H20N2O2/c16-12(9-2-1-3-9)14-11-6-7-15(8-11)13(17)10-4-5-10/h9-11H,1-8H2,(H,14,16)
InChIKeyGPYLNPSLJRHMFA-UHFFFAOYSA-N
XLogP0.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide?
The IUPAC name of N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide (CID 53016353) is N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide.
What is the SMILES notation for N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide?
The canonical SMILES for N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide is O=C(NC1CCN(C(=O)C2CC2)C1)C1CCC1.
What is the InChIKey of N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide?
The InChIKey is GPYLNPSLJRHMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c16-12(9-2-1-3-9)14-11-6-7-15(8-11)13(17)10-4-5-10/h9-11H,1-8H2,(H,14,16).
What are the key properties of N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide?
N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide has a molecular weight of 236.31 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]cyclobutanecarboxamide is sourced from PubChem (CID 53016353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).