N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide

C11H20N2O — CID 83080870

IUPACN-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide
SMILESCCC1(C(=O)N(C)C2CC2)CCCN1
InChIInChI=1S/C11H20N2O/c1-3-11(7-4-8-12-11)10(14)13(2)9-5-6-9/h9,12H,3-8H2,1-2H3
InChIKeyHSTNKMYEXVHNPS-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.14
Rot. Bonds3

About N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide

N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide (PubChem CID 83080870) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide
PubChem CID83080870
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide
SMILESCCC1(C(=O)N(C)C2CC2)CCCN1
InChIInChI=1S/C11H20N2O/c1-3-11(7-4-8-12-11)10(14)13(2)9-5-6-9/h9,12H,3-8H2,1-2H3
InChIKeyHSTNKMYEXVHNPS-UHFFFAOYSA-N
XLogP1.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide (CID 83080870) is N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide is CCC1(C(=O)N(C)C2CC2)CCCN1.
What is the InChIKey of N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide?
The InChIKey is HSTNKMYEXVHNPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-11(7-4-8-12-11)10(14)13(2)9-5-6-9/h9,12H,3-8H2,1-2H3.
What are the key properties of N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide?
N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide has a molecular weight of 196.29 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 83080870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).