(4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide

C16H21N3O3S — CID 95321791

IUPAC(4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide
SMILESCOc1ccncc1NC(=O)[C@@H]1CSCN1C(=O)C1CCCC1
InChIInChI=1S/C16H21N3O3S/c1-22-14-6-7-17-8-12(14)18-15(20)13-9-23-10-19(13)16(21)11-4-2-3-5-11/h6-8,11,13H,2-5,9-10H2,1H3,(H,18,20)/t13-/m0/s1
InChIKeyAWNYQAISNHYAOT-ZDUSSCGKSA-N
MW335.43 g/mol
LogP2.12
Rot. Bonds4

About (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide

(4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 95321791) has the molecular formula C16H21N3O3S and a molecular weight of 335.43 g/mol. Its IUPAC name is (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide
PubChem CID95321791
Molecular FormulaC16H21N3O3S
Molecular Weight335.43 g/mol
Exact Mass335.13
IUPAC Name(4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide
SMILESCOc1ccncc1NC(=O)[C@@H]1CSCN1C(=O)C1CCCC1
InChIInChI=1S/C16H21N3O3S/c1-22-14-6-7-17-8-12(14)18-15(20)13-9-23-10-19(13)16(21)11-4-2-3-5-11/h6-8,11,13H,2-5,9-10H2,1H3,(H,18,20)/t13-/m0/s1
InChIKeyAWNYQAISNHYAOT-ZDUSSCGKSA-N
XLogP2.12
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.43
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl (2S)-2-[(4-methoxy-3-pyridinyl)carbamoyl]piperidine-1-carboxylate
CID 75467196
(4S)-3-(cyclopentanecarbonyl)-N-(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-thiazolidine-4-carboxamide
CID 95614343
(4S)-N-(4-cyanophenyl)-3-(cyclobutanecarbonyl)-1,3-thiazolidine-4-carboxamide
CID 95158933
1-[(4-fluorophenyl)methyl]-N-(4-methoxy-3-pyridinyl)pyrrolidine-2-carboxamide
CID 71982296
(4S)-3-(cyclobutanecarbonyl)-N-[3-(methylcarbamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 95614265
N-(4-methoxy-3-pyridinyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;dihydrochloride
CID 119868819
N-(2-methoxyphenyl)-3-[(E)-2-methylpent-2-enoyl]-1,3-thiazolidine-4-carboxamide
CID 132969961
(3S)-4-benzyl-N-(4-methoxy-3-pyridinyl)-5-oxomorpholine-3-carboxamide
CID 97064438
(4S)-N-(4-cyanophenyl)-3-(cyclopropanecarbonyl)-1,3-thiazolidine-4-carboxamide
CID 95156736
(2R,3R)-2-ethyl-N-(4-methoxy-3-pyridinyl)oxane-3-carboxamide
CID 129479124
3-[(4-methyl-3-pyridinyl)carbamoyl]-1,3-thiazolidine-4-carboxylic acid
CID 63327691
N-(3-amino-4-methoxyphenyl)-3-(2,2-dimethylpropanoyl)-1,3-thiazolidine-4-carboxamide
CID 119419740

Frequently Asked Questions

What is the IUPAC name of (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide (CID 95321791) is (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide is COc1ccncc1NC(=O)[C@@H]1CSCN1C(=O)C1CCCC1.
What is the InChIKey of (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is AWNYQAISNHYAOT-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H21N3O3S/c1-22-14-6-7-17-8-12(14)18-15(20)13-9-23-10-19(13)16(21)11-4-2-3-5-11/h6-8,11,13H,2-5,9-10H2,1H3,(H,18,20)/t13-/m0/s1.
What are the key properties of (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide?
(4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 335.43 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-(cyclopentanecarbonyl)-N-(4-methoxy-3-pyridinyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 95321791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).