N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide

C17H24N6O2 — CID 129379229

IUPACN-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESCc1noc([C@H](NC(=O)C2CCN(c3cnccn3)CC2)C(C)C)n1
InChIInChI=1S/C17H24N6O2/c1-11(2)15(17-20-12(3)22-25-17)21-16(24)13-4-8-23(9-5-13)14-10-18-6-7-19-14/h6-7,10-11,13,15H,4-5,8-9H2,1-3H3,(H,21,24)/t15-/m1/s1
InChIKeyMORXVBZHLMRYFC-OAHLLOKOSA-N
MW344.42 g/mol
LogP1.90
Rot. Bonds5

About N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide

N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide (PubChem CID 129379229) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
PubChem CID129379229
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC NameN-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESCc1noc([C@H](NC(=O)C2CCN(c3cnccn3)CC2)C(C)C)n1
InChIInChI=1S/C17H24N6O2/c1-11(2)15(17-20-12(3)22-25-17)21-16(24)13-4-8-23(9-5-13)14-10-18-6-7-19-14/h6-7,10-11,13,15H,4-5,8-9H2,1-3H3,(H,21,24)/t15-/m1/s1
InChIKeyMORXVBZHLMRYFC-OAHLLOKOSA-N
XLogP1.90
TPSA97.04 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The IUPAC name of N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide (CID 129379229) is N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide is Cc1noc([C@H](NC(=O)C2CCN(c3cnccn3)CC2)C(C)C)n1.
What is the InChIKey of N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The InChIKey is MORXVBZHLMRYFC-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H24N6O2/c1-11(2)15(17-20-12(3)22-25-17)21-16(24)13-4-8-23(9-5-13)14-10-18-6-7-19-14/h6-7,10-11,13,15H,4-5,8-9H2,1-3H3,(H,21,24)/t15-/m1/s1.
What are the key properties of N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 129379229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).