N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide

C13H24N2O2 — CID 71969922

IUPACN-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide
SMILESCOCCC1(CNC(=O)N2CCCC2)CCC1
InChIInChI=1S/C13H24N2O2/c1-17-10-7-13(5-4-6-13)11-14-12(16)15-8-2-3-9-15/h2-11H2,1H3,(H,14,16)
InChIKeyPPXJKOUSURFUAL-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.00
Rot. Bonds5

About N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide

N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide (PubChem CID 71969922) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide
PubChem CID71969922
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide
SMILESCOCCC1(CNC(=O)N2CCCC2)CCC1
InChIInChI=1S/C13H24N2O2/c1-17-10-7-13(5-4-6-13)11-14-12(16)15-8-2-3-9-15/h2-11H2,1H3,(H,14,16)
InChIKeyPPXJKOUSURFUAL-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide (CID 71969922) is N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide is COCCC1(CNC(=O)N2CCCC2)CCC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide?
The InChIKey is PPXJKOUSURFUAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-17-10-7-13(5-4-6-13)11-14-12(16)15-8-2-3-9-15/h2-11H2,1H3,(H,14,16).
What are the key properties of N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide?
N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 71969922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).