1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide

C14H21N3O3 — CID 171675304

IUPAC1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide
SMILESCOCCN1CC(C(=O)NCCc2ccc[nH]2)CC1=O
InChIInChI=1S/C14H21N3O3/c1-20-8-7-17-10-11(9-13(17)18)14(19)16-6-4-12-3-2-5-15-12/h2-3,5,11,15H,4,6-10H2,1H3,(H,16,19)
InChIKeyXZAWLALWAHOBLX-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.17
Rot. Bonds7

About 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide

1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide (PubChem CID 171675304) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide
PubChem CID171675304
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide
SMILESCOCCN1CC(C(=O)NCCc2ccc[nH]2)CC1=O
InChIInChI=1S/C14H21N3O3/c1-20-8-7-17-10-11(9-13(17)18)14(19)16-6-4-12-3-2-5-15-12/h2-3,5,11,15H,4,6-10H2,1H3,(H,16,19)
InChIKeyXZAWLALWAHOBLX-UHFFFAOYSA-N
XLogP0.17
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1H-indol-3-yl)ethyl]-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 113182459
N-[2-(2-hydroxyethoxy)ethyl]-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 55024342
3-[[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid
CID 43354871
N-(2-indol-1-ylethyl)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 108726452
methyl (E)-5-[[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]pent-2-enoate
CID 146099920
1-(2-methoxyethyl)-5-oxo-N-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide
CID 119444938
N-(2-methoxyethyl)-1-(3-methoxypropyl)-5-oxopyrrolidine-3-carboxamide
CID 113182494
N-[2-(2-fluorophenyl)ethyl]-1-(3-methoxypropyl)-5-oxopyrrolidine-3-carboxamide
CID 113182519
N-[2-(2-methoxyphenyl)ethyl]-1-(3-methoxypropyl)-5-oxopyrrolidine-3-carboxamide
CID 113182521
(3R)-1-(2-methoxyethyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 94045996
N-[2-(4-chlorophenyl)ethyl]-1-(3-methoxypropyl)-5-oxopyrrolidine-3-carboxamide
CID 113182532
(3R)-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 94045963

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide (CID 171675304) is 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide is COCCN1CC(C(=O)NCCc2ccc[nH]2)CC1=O.
What is the InChIKey of 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide?
The InChIKey is XZAWLALWAHOBLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-20-8-7-17-10-11(9-13(17)18)14(19)16-6-4-12-3-2-5-15-12/h2-3,5,11,15H,4,6-10H2,1H3,(H,16,19).
What are the key properties of 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide?
1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 0.17, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-5-oxo-N-[2-(1H-pyrrol-2-yl)ethyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 171675304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).