(2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide

C19H24N4O3 — CID 164631634

IUPAC(2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide
SMILESCC(=O)c1ccccc1NC(=O)[C@H](C)N1CCC(c2nc(C)no2)CC1
InChIInChI=1S/C19H24N4O3/c1-12(18(25)21-17-7-5-4-6-16(17)13(2)24)23-10-8-15(9-11-23)19-20-14(3)22-26-19/h4-7,12,15H,8-11H2,1-3H3,(H,21,25)/t12-/m0/s1
InChIKeyZZYQCKMTNVOKMW-LBPRGKRZSA-N
MW356.43 g/mol
LogP2.79
Rot. Bonds5

About (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide

(2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide (PubChem CID 164631634) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide.

Molecular Properties

Compound Name(2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide
PubChem CID164631634
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name(2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide
SMILESCC(=O)c1ccccc1NC(=O)[C@H](C)N1CCC(c2nc(C)no2)CC1
InChIInChI=1S/C19H24N4O3/c1-12(18(25)21-17-7-5-4-6-16(17)13(2)24)23-10-8-15(9-11-23)19-20-14(3)22-26-19/h4-7,12,15H,8-11H2,1-3H3,(H,21,25)/t12-/m0/s1
InChIKeyZZYQCKMTNVOKMW-LBPRGKRZSA-N
XLogP2.79
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide 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 (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide?
The IUPAC name of (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide (CID 164631634) is (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide.
What is the SMILES notation for (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide?
The canonical SMILES for (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide is CC(=O)c1ccccc1NC(=O)[C@H](C)N1CCC(c2nc(C)no2)CC1.
What is the InChIKey of (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide?
The InChIKey is ZZYQCKMTNVOKMW-LBPRGKRZSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-12(18(25)21-17-7-5-4-6-16(17)13(2)24)23-10-8-15(9-11-23)19-20-14(3)22-26-19/h4-7,12,15H,8-11H2,1-3H3,(H,21,25)/t12-/m0/s1.
What are the key properties of (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide?
(2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide has a molecular weight of 356.43 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-acetylphenyl)-2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide is sourced from PubChem (CID 164631634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).