1-ethylpyrrolidine-2-carboxamide

C7H14N2O — CID 566738

IUPAC1-ethylpyrrolidine-2-carboxamide
SMILESCCN1CCCC1C(N)=O
InChIInChI=1S/C7H14N2O/c1-2-9-5-3-4-6(9)7(8)10/h6H,2-5H2,1H3,(H2,8,10)
InChIKeyLQOASEHNECNLNM-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.04
Rot. Bonds2

About 1-ethylpyrrolidine-2-carboxamide

1-ethylpyrrolidine-2-carboxamide (PubChem CID 566738) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-ethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-ethylpyrrolidine-2-carboxamide
PubChem CID566738
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name1-ethylpyrrolidine-2-carboxamide
SMILESCCN1CCCC1C(N)=O
InChIInChI=1S/C7H14N2O/c1-2-9-5-3-4-6(9)7(8)10/h6H,2-5H2,1H3,(H2,8,10)
InChIKeyLQOASEHNECNLNM-UHFFFAOYSA-N
XLogP-0.04
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethylpyrrolidine-2-carboxamide?
The IUPAC name of 1-ethylpyrrolidine-2-carboxamide (CID 566738) is 1-ethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-ethylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-ethylpyrrolidine-2-carboxamide is CCN1CCCC1C(N)=O.
What is the InChIKey of 1-ethylpyrrolidine-2-carboxamide?
The InChIKey is LQOASEHNECNLNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-2-9-5-3-4-6(9)7(8)10/h6H,2-5H2,1H3,(H2,8,10).
What are the key properties of 1-ethylpyrrolidine-2-carboxamide?
1-ethylpyrrolidine-2-carboxamide has a molecular weight of 142.20 g/mol, XLogP of -0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 566738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).