N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide

C14H23N3O3 — CID 154796898

IUPACN-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
SMILESCC1CCC(NC(=O)Cn2c(C(C)C)noc2=O)CC1
InChIInChI=1S/C14H23N3O3/c1-9(2)13-16-20-14(19)17(13)8-12(18)15-11-6-4-10(3)5-7-11/h9-11H,4-8H2,1-3H3,(H,15,18)
InChIKeyYIDSNFDAIBOMPB-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.65
Rot. Bonds4

About N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide

N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide (PubChem CID 154796898) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
PubChem CID154796898
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC NameN-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
SMILESCC1CCC(NC(=O)Cn2c(C(C)C)noc2=O)CC1
InChIInChI=1S/C14H23N3O3/c1-9(2)13-16-20-14(19)17(13)8-12(18)15-11-6-4-10(3)5-7-11/h9-11H,4-8H2,1-3H3,(H,15,18)
InChIKeyYIDSNFDAIBOMPB-UHFFFAOYSA-N
XLogP1.65
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide
CID 146075514
2-[[4-[2-(cyclopropylamino)-2-oxoethyl]-5-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
CID 43568490
2-[(3aR,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(4-methylcyclohexyl)acetamide
CID 27787243
2-[2-(1-chloroethyl)-5-fluorobenzimidazol-1-yl]-N-cyclopropylacetamide
CID 43667749
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(4-methylcyclohexyl)acetamide
CID 18121435
N-cyclopropyl-2-(3,5-dimethyl-2,4,6-trioxo-1,3,5-triazinan-1-yl)acetamide
CID 26435326
(3S)-3-hydroxy-N-(4-methylcyclohexyl)butanamide
CID 89423792
2-[4-(hydroxymethyl)triazol-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 62400544
2-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 134045389
3-amino-N-(4-methylcyclohexyl)butanamide
CID 60835833
N-(4-methylcyclohexyl)-2-(4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl)acetamide
CID 139000242
N-cyclopropyl-2-(4-propan-2-yl-2-sulfanylidene-1H-imidazol-3-yl)acetamide
CID 64863739

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The IUPAC name of N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide (CID 154796898) is N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The canonical SMILES for N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide is CC1CCC(NC(=O)Cn2c(C(C)C)noc2=O)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The InChIKey is YIDSNFDAIBOMPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-9(2)13-16-20-14(19)17(13)8-12(18)15-11-6-4-10(3)5-7-11/h9-11H,4-8H2,1-3H3,(H,15,18).
What are the key properties of N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide has a molecular weight of 281.36 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide is sourced from PubChem (CID 154796898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).