N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide

C12H24N2O2 — CID 59535639

IUPACN-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide
SMILESCCCN1CCC(C(=O)N(C)CCOC)C1
InChIInChI=1S/C12H24N2O2/c1-4-6-14-7-5-11(10-14)12(15)13(2)8-9-16-3/h11H,4-10H2,1-3H3
InChIKeyKBCCGRVNHBQRHN-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.82
Rot. Bonds6

About N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide

N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide (PubChem CID 59535639) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide
PubChem CID59535639
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide
SMILESCCCN1CCC(C(=O)N(C)CCOC)C1
InChIInChI=1S/C12H24N2O2/c1-4-6-14-7-5-11(10-14)12(15)13(2)8-9-16-3/h11H,4-10H2,1-3H3
InChIKeyKBCCGRVNHBQRHN-UHFFFAOYSA-N
XLogP0.82
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide (CID 59535639) is N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide is CCCN1CCC(C(=O)N(C)CCOC)C1.
What is the InChIKey of N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide?
The InChIKey is KBCCGRVNHBQRHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-6-14-7-5-11(10-14)12(15)13(2)8-9-16-3/h11H,4-10H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide?
N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 0.82, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methyl-1-propylpyrrolidine-3-carboxamide is sourced from PubChem (CID 59535639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).