N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide

C15H24N4O2 — CID 25338675

IUPACN-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide
SMILESCc1noc([C@@H]2C[C@H](NC(=O)C3CCCCC3)CN2C)n1
InChIInChI=1S/C15H24N4O2/c1-10-16-15(21-18-10)13-8-12(9-19(13)2)17-14(20)11-6-4-3-5-7-11/h11-13H,3-9H2,1-2H3,(H,17,20)/t12-,13-/m0/s1
InChIKeyMOEZNJVLACFKJK-STQMWFEESA-N
MW292.38 g/mol
LogP1.82
Rot. Bonds3

About N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide

N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide (PubChem CID 25338675) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide
PubChem CID25338675
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide
SMILESCc1noc([C@@H]2C[C@H](NC(=O)C3CCCCC3)CN2C)n1
InChIInChI=1S/C15H24N4O2/c1-10-16-15(21-18-10)13-8-12(9-19(13)2)17-14(20)11-6-4-3-5-7-11/h11-13H,3-9H2,1-2H3,(H,17,20)/t12-,13-/m0/s1
InChIKeyMOEZNJVLACFKJK-STQMWFEESA-N
XLogP1.82
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide 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 N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide?
The IUPAC name of N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide (CID 25338675) is N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide is Cc1noc([C@@H]2C[C@H](NC(=O)C3CCCCC3)CN2C)n1.
What is the InChIKey of N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide?
The InChIKey is MOEZNJVLACFKJK-STQMWFEESA-N. The full InChI is InChI=1S/C15H24N4O2/c1-10-16-15(21-18-10)13-8-12(9-19(13)2)17-14(20)11-6-4-3-5-7-11/h11-13H,3-9H2,1-2H3,(H,17,20)/t12-,13-/m0/s1.
What are the key properties of N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide?
N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S,5S)-1-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]cyclohexanecarboxamide is sourced from PubChem (CID 25338675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).