2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide

C19H23N3O2 — CID 131914007

IUPAC2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide
SMILESCC1CCC(=O)N1c1cccc(NC(=O)C(C)(C)n2cccc2)c1
InChIInChI=1S/C19H23N3O2/c1-14-9-10-17(23)22(14)16-8-6-7-15(13-16)20-18(24)19(2,3)21-11-4-5-12-21/h4-8,11-14H,9-10H2,1-3H3,(H,20,24)
InChIKeyMWNZZJXTMTUDAU-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.38
Rot. Bonds4

About 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide

2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide (PubChem CID 131914007) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide.

Molecular Properties

Compound Name2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide
PubChem CID131914007
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide
SMILESCC1CCC(=O)N1c1cccc(NC(=O)C(C)(C)n2cccc2)c1
InChIInChI=1S/C19H23N3O2/c1-14-9-10-17(23)22(14)16-8-6-7-15(13-16)20-18(24)19(2,3)21-11-4-5-12-21/h4-8,11-14H,9-10H2,1-3H3,(H,20,24)
InChIKeyMWNZZJXTMTUDAU-UHFFFAOYSA-N
XLogP3.38
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(3-aminophenyl)-2-methyl-2-(4-oxo-1-pyridinyl)propanamide
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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide?
The IUPAC name of 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide (CID 131914007) is 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide.
What is the SMILES notation for 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide?
The canonical SMILES for 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide is CC1CCC(=O)N1c1cccc(NC(=O)C(C)(C)n2cccc2)c1.
What is the InChIKey of 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide?
The InChIKey is MWNZZJXTMTUDAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-14-9-10-17(23)22(14)16-8-6-7-15(13-16)20-18(24)19(2,3)21-11-4-5-12-21/h4-8,11-14H,9-10H2,1-3H3,(H,20,24).
What are the key properties of 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide?
2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide has a molecular weight of 325.41 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-pyrrol-1-ylpropanamide is sourced from PubChem (CID 131914007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).