2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide

C15H24N4O3S — CID 118792245

IUPAC2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide
SMILESCCNc1nc(C)c(C(=O)NCC2CC(=O)N(CCOC)C2)s1
InChIInChI=1S/C15H24N4O3S/c1-4-16-15-18-10(2)13(23-15)14(21)17-8-11-7-12(20)19(9-11)5-6-22-3/h11H,4-9H2,1-3H3,(H,16,18)(H,17,21)
InChIKeyFIQSTRGHCNMAFH-UHFFFAOYSA-N
MW340.45 g/mol
LogP1.11
Rot. Bonds8

About 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide

2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 118792245) has the molecular formula C15H24N4O3S and a molecular weight of 340.45 g/mol. Its IUPAC name is 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide
PubChem CID118792245
Molecular FormulaC15H24N4O3S
Molecular Weight340.45 g/mol
Exact Mass340.16
IUPAC Name2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide
SMILESCCNc1nc(C)c(C(=O)NCC2CC(=O)N(CCOC)C2)s1
InChIInChI=1S/C15H24N4O3S/c1-4-16-15-18-10(2)13(23-15)14(21)17-8-11-7-12(20)19(9-11)5-6-22-3/h11H,4-9H2,1-3H3,(H,16,18)(H,17,21)
InChIKeyFIQSTRGHCNMAFH-UHFFFAOYSA-N
XLogP1.11
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-hydroxy-N-[[(3S)-1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methylbenzamide
CID 125169497
N-[[(3S)-1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-2-pyridin-4-ylpyrimidine-5-carboxamide
CID 125177385
N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-2-pyridin-4-ylpyrimidine-5-carboxamide
CID 118788931
3-amino-N-[[(3S)-1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-phenyl-1H-pyrazole-5-carboxamide
CID 99927250
2-chloro-N-[[(3R)-1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-5-(trifluoromethyl)benzamide
CID 124848979
3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid
CID 112514282
3-(4-fluorophenyl)-N-[[(3R)-1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]benzamide
CID 124842945
4-[[(2-aminopyrimidin-4-yl)amino]methyl]-1-(2-methoxyethyl)pyrrolidin-2-one
CID 131917049
2-(ethylamino)-4-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-1,3-thiazole-5-carboxamide
CID 131933167
2-[[(3S)-1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-5,6-dimethylpyridine-3-carboxamide
CID 124846696
N-(2-amino-2-methylpropyl)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 119625881
N-[[(3S)-1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-3-[6-(methylamino)-3-pyridinyl]benzamide
CID 125448469

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide (CID 118792245) is 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide is CCNc1nc(C)c(C(=O)NCC2CC(=O)N(CCOC)C2)s1.
What is the InChIKey of 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is FIQSTRGHCNMAFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3S/c1-4-16-15-18-10(2)13(23-15)14(21)17-8-11-7-12(20)19(9-11)5-6-22-3/h11H,4-9H2,1-3H3,(H,16,18)(H,17,21).
What are the key properties of 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide?
2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 340.45 g/mol, XLogP of 1.11, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 118792245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).