(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide

C17H25N3O2S — CID 92632344

IUPAC(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide
SMILESCc1nc(CC(=O)N2CCC[C@]2(C)C(=O)NC2CCCC2)cs1
InChIInChI=1S/C17H25N3O2S/c1-12-18-14(11-23-12)10-15(21)20-9-5-8-17(20,2)16(22)19-13-6-3-4-7-13/h11,13H,3-10H2,1-2H3,(H,19,22)/t17-/m1/s1
InChIKeyVKKWFIQINPVVCL-QGZVFWFLSA-N
MW335.47 g/mol
LogP2.43
Rot. Bonds4

About (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide

(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide (PubChem CID 92632344) has the molecular formula C17H25N3O2S and a molecular weight of 335.47 g/mol. Its IUPAC name is (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide
PubChem CID92632344
Molecular FormulaC17H25N3O2S
Molecular Weight335.47 g/mol
Exact Mass335.17
IUPAC Name(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide
SMILESCc1nc(CC(=O)N2CCC[C@]2(C)C(=O)NC2CCCC2)cs1
InChIInChI=1S/C17H25N3O2S/c1-12-18-14(11-23-12)10-15(21)20-9-5-8-17(20,2)16(22)19-13-6-3-4-7-13/h11,13H,3-10H2,1-2H3,(H,19,22)/t17-/m1/s1
InChIKeyVKKWFIQINPVVCL-QGZVFWFLSA-N
XLogP2.43
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.47
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide
CID 95851894
(2R)-N-cyclopentyl-4-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]morpholine-2-carboxamide
CID 92633297
N-cyclopropyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide
CID 47164618
N-(4-hydroxycyclohexyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 43389129
3-cyclopentyl-1-[4-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperazin-1-yl]propan-1-one
CID 134020946
N-cyclopentyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazine-1-carboxamide
CID 38204358
1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidine-2-carboxylic acid
CID 43355974
methyl (2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidine-2-carboxylate
CID 79833335
1-methyl-2-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 83213901
ethyl 4-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]piperidine-1-carboxylate
CID 31339684
N-cyclopentyl-3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propanamide
CID 16908989
3-cyclooctyl-1-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]urea
CID 47455518

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide (CID 92632344) is (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide is Cc1nc(CC(=O)N2CCC[C@]2(C)C(=O)NC2CCCC2)cs1.
What is the InChIKey of (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide?
The InChIKey is VKKWFIQINPVVCL-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H25N3O2S/c1-12-18-14(11-23-12)10-15(21)20-9-5-8-17(20,2)16(22)19-13-6-3-4-7-13/h11,13H,3-10H2,1-2H3,(H,19,22)/t17-/m1/s1.
What are the key properties of (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide?
(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide has a molecular weight of 335.47 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 92632344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).