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

C17H23N3O2S — CID 126771526

IUPAC4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide
SMILESO=C(NCC1CC(=O)N(C2CC2)C1)c1scnc1C1CCCC1
InChIInChI=1S/C17H23N3O2S/c21-14-7-11(9-20(14)13-5-6-13)8-18-17(22)16-15(19-10-23-16)12-3-1-2-4-12/h10-13H,1-9H2,(H,18,22)
InChIKeyXPSXRMXXVYHWFK-UHFFFAOYSA-N
MW333.46 g/mol
LogP2.54
Rot. Bonds5

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

4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide (PubChem CID 126771526) has the molecular formula C17H23N3O2S and a molecular weight of 333.46 g/mol. Its IUPAC name is 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide
PubChem CID126771526
Molecular FormulaC17H23N3O2S
Molecular Weight333.46 g/mol
Exact Mass333.15
IUPAC Name4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide
SMILESO=C(NCC1CC(=O)N(C2CC2)C1)c1scnc1C1CCCC1
InChIInChI=1S/C17H23N3O2S/c21-14-7-11(9-20(14)13-5-6-13)8-18-17(22)16-15(19-10-23-16)12-3-1-2-4-12/h10-13H,1-9H2,(H,18,22)
InChIKeyXPSXRMXXVYHWFK-UHFFFAOYSA-N
XLogP2.54
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.46
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-2-oxo-6-propan-2-yl-1H-pyridine-3-carboxamide
CID 131906921
N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide
CID 95550589
N-[[(3S)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-3-methylpyridine-4-carboxamide
CID 125160120
N-(cyclobutylmethylsulfonyl)-4-cyclopentyl-1,3-thiazole-5-carboxamide
CID 99783513
N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 110743227
N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-2-phenylacetamide
CID 110719865
2-chloro-N-[[(3R)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]-5-methyl-1,3-thiazole-4-carboxamide
CID 124741356
N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]-2-propylpyrazole-3-carboxamide
CID 125169973
N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-2-fluoro-4-methylbenzamide
CID 125174216
4-(6-aminopyrimidin-4-yl)-N-[[(3S)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]benzamide
CID 126432710
N-[[(3R)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]pyrazolo[1,5-a]pyridine-7-carboxamide
CID 95712406
N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-3-pyrrolidin-1-ylpyrrolidine-1-carboxamide
CID 136521897

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide (CID 126771526) is 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide is O=C(NCC1CC(=O)N(C2CC2)C1)c1scnc1C1CCCC1.
What is the InChIKey of 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide?
The InChIKey is XPSXRMXXVYHWFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2S/c21-14-7-11(9-20(14)13-5-6-13)8-18-17(22)16-15(19-10-23-16)12-3-1-2-4-12/h10-13H,1-9H2,(H,18,22).
What are the key properties of 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide?
4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide has a molecular weight of 333.46 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 126771526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).