N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide

C17H25N3O2S — CID 95550589

IUPACN-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide
SMILESCCc1nc(C)sc1C(=O)NC[C@H]1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C17H25N3O2S/c1-3-14-16(23-11(2)19-14)17(22)18-9-12-8-15(21)20(10-12)13-6-4-5-7-13/h12-13H,3-10H2,1-2H3,(H,18,22)/t12-/m1/s1
InChIKeyNJAOAVBQSPJBRA-GFCCVEGCSA-N
MW335.47 g/mol
LogP2.53
Rot. Bonds5

About N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide

N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide (PubChem CID 95550589) has the molecular formula C17H25N3O2S and a molecular weight of 335.47 g/mol. Its IUPAC name is N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide
PubChem CID95550589
Molecular FormulaC17H25N3O2S
Molecular Weight335.47 g/mol
Exact Mass335.17
IUPAC NameN-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide
SMILESCCc1nc(C)sc1C(=O)NC[C@H]1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C17H25N3O2S/c1-3-14-16(23-11(2)19-14)17(22)18-9-12-8-15(21)20(10-12)13-6-4-5-7-13/h12-13H,3-10H2,1-2H3,(H,18,22)/t12-/m1/s1
InChIKeyNJAOAVBQSPJBRA-GFCCVEGCSA-N
XLogP2.53
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.47
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide with MolForge

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Related Compounds

2-chloro-N-[[(3R)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]-5-methyl-1,3-thiazole-4-carboxamide
CID 124741356
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CID 125160120
4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide
CID 126771526
4-ethyl-2-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 56714098
N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-2-fluoro-4-methylbenzamide
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CID 26722502
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N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-3-methoxy-2-methylbenzamide
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CID 75500635
N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-2-oxo-6-propan-2-yl-1H-pyridine-3-carboxamide
CID 131906921
(4S)-1-cyclopentyl-4-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]pyrrolidin-2-one
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Frequently Asked Questions

What is the IUPAC name of N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide (CID 95550589) is N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide is CCc1nc(C)sc1C(=O)NC[C@H]1CC(=O)N(C2CCCC2)C1.
What is the InChIKey of N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is NJAOAVBQSPJBRA-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H25N3O2S/c1-3-14-16(23-11(2)19-14)17(22)18-9-12-8-15(21)20(10-12)13-6-4-5-7-13/h12-13H,3-10H2,1-2H3,(H,18,22)/t12-/m1/s1.
What are the key properties of N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide?
N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 335.47 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 95550589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).