N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide

C13H26N2O — CID 106974201

IUPACN-ethyl-N,2-dipropylpyrrolidine-2-carboxamide
SMILESCCCN(CC)C(=O)C1(CCC)CCCN1
InChIInChI=1S/C13H26N2O/c1-4-8-13(9-7-10-14-13)12(16)15(6-3)11-5-2/h14H,4-11H2,1-3H3
InChIKeyFWGRUDDERXQVAS-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.17
Rot. Bonds6

About N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide

N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide (PubChem CID 106974201) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N,2-dipropylpyrrolidine-2-carboxamide
PubChem CID106974201
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-ethyl-N,2-dipropylpyrrolidine-2-carboxamide
SMILESCCCN(CC)C(=O)C1(CCC)CCCN1
InChIInChI=1S/C13H26N2O/c1-4-8-13(9-7-10-14-13)12(16)15(6-3)11-5-2/h14H,4-11H2,1-3H3
InChIKeyFWGRUDDERXQVAS-UHFFFAOYSA-N
XLogP2.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide?
The IUPAC name of N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide (CID 106974201) is N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide?
The canonical SMILES for N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide is CCCN(CC)C(=O)C1(CCC)CCCN1.
What is the InChIKey of N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide?
The InChIKey is FWGRUDDERXQVAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-8-13(9-7-10-14-13)12(16)15(6-3)11-5-2/h14H,4-11H2,1-3H3.
What are the key properties of N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide?
N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide has a molecular weight of 226.36 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2-dipropylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106974201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).