N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide

C11H16N6O2 — CID 154738324

IUPACN-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
SMILESCc1noc(CCCC(=O)Nc2nc(C)nn2C)n1
InChIInChI=1S/C11H16N6O2/c1-7-13-11(17(3)15-7)14-9(18)5-4-6-10-12-8(2)16-19-10/h4-6H2,1-3H3,(H,13,14,15,18)
InChIKeyZWNFCBAZSRLEPC-UHFFFAOYSA-N
MW264.29 g/mol
LogP0.78
Rot. Bonds5

About N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide

N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide (PubChem CID 154738324) has the molecular formula C11H16N6O2 and a molecular weight of 264.29 g/mol. Its IUPAC name is N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide.

Molecular Properties

Compound NameN-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
PubChem CID154738324
Molecular FormulaC11H16N6O2
Molecular Weight264.29 g/mol
Exact Mass264.13
IUPAC NameN-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
SMILESCc1noc(CCCC(=O)Nc2nc(C)nn2C)n1
InChIInChI=1S/C11H16N6O2/c1-7-13-11(17(3)15-7)14-9(18)5-4-6-10-12-8(2)16-19-10/h4-6H2,1-3H3,(H,13,14,15,18)
InChIKeyZWNFCBAZSRLEPC-UHFFFAOYSA-N
XLogP0.78
TPSA98.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2,5-dimethyl-1,2,4-triazol-3-yl)hept-6-ynamide
CID 86790800
4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-pyridin-2-ylbutanamide
CID 47208997
N,N-diethyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 86982229
N-(2-fluoro-4-methylphenyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 47180517
N-(4-bromo-3-methylphenyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 47180626
N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 94025784
N-[4-(difluoromethylsulfanyl)phenyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 51082840
N-(2-amino-2-ethylbutyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 119643264
4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[4-methyl-1-(1-phenylethyl)pyrazol-3-yl]butanamide
CID 119045772
N-[5-(5-methylfuran-2-yl)-1H-1,2,4-triazol-3-yl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 154750417
2-[ethyl-[4-(3-methyl-1,2,4-oxadiazol-5-yl)butanoyl]amino]acetic acid
CID 119205867
N-(2-amino-2-ethylbutyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide;hydrochloride
CID 119643263

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide?
The IUPAC name of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide (CID 154738324) is N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide.
What is the SMILES notation for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide?
The canonical SMILES for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide is Cc1noc(CCCC(=O)Nc2nc(C)nn2C)n1.
What is the InChIKey of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide?
The InChIKey is ZWNFCBAZSRLEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6O2/c1-7-13-11(17(3)15-7)14-9(18)5-4-6-10-12-8(2)16-19-10/h4-6H2,1-3H3,(H,13,14,15,18).
What are the key properties of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide?
N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide has a molecular weight of 264.29 g/mol, XLogP of 0.78, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide is sourced from PubChem (CID 154738324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).