1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide

C16H25N5O5 — CID 130234942

IUPAC1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide
SMILESCC(=O)N1CCCC1(C)C(=O)N(C)CC(=O)N[C@H](c1nnco1)[C@@H](C)O
InChIInChI=1S/C16H25N5O5/c1-10(22)13(14-19-17-9-26-14)18-12(24)8-20(4)15(25)16(3)6-5-7-21(16)11(2)23/h9-10,13,22H,5-8H2,1-4H3,(H,18,24)/t10-,13+,16?/m1/s1
InChIKeyQAXKZDGFGGQBAW-QWWHPRRQSA-N
MW367.41 g/mol
LogP-0.53
Rot. Bonds6

About 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide

1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide (PubChem CID 130234942) has the molecular formula C16H25N5O5 and a molecular weight of 367.41 g/mol. Its IUPAC name is 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide
PubChem CID130234942
Molecular FormulaC16H25N5O5
Molecular Weight367.41 g/mol
Exact Mass367.19
IUPAC Name1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide
SMILESCC(=O)N1CCCC1(C)C(=O)N(C)CC(=O)N[C@H](c1nnco1)[C@@H](C)O
InChIInChI=1S/C16H25N5O5/c1-10(22)13(14-19-17-9-26-14)18-12(24)8-20(4)15(25)16(3)6-5-7-21(16)11(2)23/h9-10,13,22H,5-8H2,1-4H3,(H,18,24)/t10-,13+,16?/m1/s1
InChIKeyQAXKZDGFGGQBAW-QWWHPRRQSA-N
XLogP-0.53
TPSA128.87 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-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

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide?
The IUPAC name of 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide (CID 130234942) is 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide is CC(=O)N1CCCC1(C)C(=O)N(C)CC(=O)N[C@H](c1nnco1)[C@@H](C)O.
What is the InChIKey of 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide?
The InChIKey is QAXKZDGFGGQBAW-QWWHPRRQSA-N. The full InChI is InChI=1S/C16H25N5O5/c1-10(22)13(14-19-17-9-26-14)18-12(24)8-20(4)15(25)16(3)6-5-7-21(16)11(2)23/h9-10,13,22H,5-8H2,1-4H3,(H,18,24)/t10-,13+,16?/m1/s1.
What are the key properties of 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide?
1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide has a molecular weight of 367.41 g/mol, XLogP of -0.53, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-[2-[[(1S,2R)-2-hydroxy-1-(1,3,4-oxadiazol-2-yl)propyl]amino]-2-oxoethyl]-N,2-dimethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 130234942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).