N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide

C15H21N7O2S — CID 129337095

IUPACN-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
SMILESCN(C)c1nc(CN2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)ns1
InChIInChI=1S/C15H21N7O2S/c1-21(2)15-17-11(20-25-15)8-22-7-3-4-10(22)14-18-12(19-24-14)13(23)16-9-5-6-9/h9-10H,3-8H2,1-2H3,(H,16,23)/t10-/m0/s1
InChIKeyLEPAFSCSNBHYOE-JTQLQIEISA-N
MW363.45 g/mol
LogP1.22
Rot. Bonds6

About N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide

N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide (PubChem CID 129337095) has the molecular formula C15H21N7O2S and a molecular weight of 363.45 g/mol. Its IUPAC name is N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
PubChem CID129337095
Molecular FormulaC15H21N7O2S
Molecular Weight363.45 g/mol
Exact Mass363.15
IUPAC NameN-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
SMILESCN(C)c1nc(CN2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)ns1
InChIInChI=1S/C15H21N7O2S/c1-21(2)15-17-11(20-25-15)8-22-7-3-4-10(22)14-18-12(19-24-14)13(23)16-9-5-6-9/h9-10H,3-8H2,1-2H3,(H,16,23)/t10-/m0/s1
InChIKeyLEPAFSCSNBHYOE-JTQLQIEISA-N
XLogP1.22
TPSA100.28 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.45
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide with MolForge

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Related Compounds

N-cyclopropyl-5-[1-(2-hydroxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129001579
N-cyclopropyl-5-[(2R)-1-(thiadiazol-4-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129338292
N-cyclopropyl-5-[(2S)-1-[(3-methylimidazol-4-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129344538
N-cyclopropyl-5-[(2R)-1-[(3-methylimidazol-4-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129344537
N-cyclopropyl-5-[(2S)-1-(oxan-4-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129330909
5-[(2R)-1-[(1-tert-butylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide
CID 129335596
N-cyclopropyl-5-[(2R)-1-[(6-propan-2-yl-2-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129331466
5-[1-(1,3-benzodioxol-4-ylmethyl)pyrrolidin-2-yl]-N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide
CID 129002469
N-cyclopropyl-5-[(2S)-1-[(6-ethoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129342811
N-cyclopropyl-5-[(2S)-1-[2-(cyclopropylmethoxy)ethyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129338909
N-cyclopropyl-5-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129003726
N-cyclopropyl-5-[(2S)-1-[(2S)-2-hydroxy-3-propan-2-yloxypropyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129330198

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide (CID 129337095) is N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide is CN(C)c1nc(CN2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)ns1.
What is the InChIKey of N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is LEPAFSCSNBHYOE-JTQLQIEISA-N. The full InChI is InChI=1S/C15H21N7O2S/c1-21(2)15-17-11(20-25-15)8-22-7-3-4-10(22)14-18-12(19-24-14)13(23)16-9-5-6-9/h9-10H,3-8H2,1-2H3,(H,16,23)/t10-/m0/s1.
What are the key properties of N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide?
N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 363.45 g/mol, XLogP of 1.22, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-[(2S)-1-[[5-(dimethylamino)-1,2,4-thiadiazol-3-yl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 129337095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).