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

C15H16N4O3 — CID 164637400

IUPACN-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide
SMILESCc1noc(CNC(=O)CC[C@@H]2C(=O)Nc3ccccc32)n1
InChIInChI=1S/C15H16N4O3/c1-9-17-14(22-19-9)8-16-13(20)7-6-11-10-4-2-3-5-12(10)18-15(11)21/h2-5,11H,6-8H2,1H3,(H,16,20)(H,18,21)/t11-/m0/s1
InChIKeyFXFWXDOLEDHXNK-NSHDSACASA-N
MW300.32 g/mol
LogP1.51
Rot. Bonds5

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

N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide (PubChem CID 164637400) has the molecular formula C15H16N4O3 and a molecular weight of 300.32 g/mol. Its IUPAC name is N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide.

Molecular Properties

Compound NameN-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide
PubChem CID164637400
Molecular FormulaC15H16N4O3
Molecular Weight300.32 g/mol
Exact Mass300.12
IUPAC NameN-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide
SMILESCc1noc(CNC(=O)CC[C@@H]2C(=O)Nc3ccccc32)n1
InChIInChI=1S/C15H16N4O3/c1-9-17-14(22-19-9)8-16-13(20)7-6-11-10-4-2-3-5-12(10)18-15(11)21/h2-5,11H,6-8H2,1H3,(H,16,20)(H,18,21)/t11-/m0/s1
InChIKeyFXFWXDOLEDHXNK-NSHDSACASA-N
XLogP1.51
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide?
The IUPAC name of N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide (CID 164637400) is N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide.
What is the SMILES notation for N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide?
The canonical SMILES for N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide is Cc1noc(CNC(=O)CC[C@@H]2C(=O)Nc3ccccc32)n1.
What is the InChIKey of N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide?
The InChIKey is FXFWXDOLEDHXNK-NSHDSACASA-N. The full InChI is InChI=1S/C15H16N4O3/c1-9-17-14(22-19-9)8-16-13(20)7-6-11-10-4-2-3-5-12(10)18-15(11)21/h2-5,11H,6-8H2,1H3,(H,16,20)(H,18,21)/t11-/m0/s1.
What are the key properties of N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide?
N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide has a molecular weight of 300.32 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]propanamide is sourced from PubChem (CID 164637400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).