N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide

C21H34N4O3 — CID 55838480

IUPACN-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide
SMILESCCCc1noc(CCCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)n1
InChIInChI=1S/C21H34N4O3/c1-2-7-18-23-20(28-24-18)11-6-10-19(26)22-17-12-14-25(15-13-17)21(27)16-8-4-3-5-9-16/h16-17H,2-15H2,1H3,(H,22,26)
InChIKeyZFOKIYKRPFUCLZ-UHFFFAOYSA-N
MW390.53 g/mol
LogP3.03
Rot. Bonds8

About N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide

N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide (PubChem CID 55838480) has the molecular formula C21H34N4O3 and a molecular weight of 390.53 g/mol. Its IUPAC name is N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide.

Molecular Properties

Compound NameN-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide
PubChem CID55838480
Molecular FormulaC21H34N4O3
Molecular Weight390.53 g/mol
Exact Mass390.26
IUPAC NameN-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide
SMILESCCCc1noc(CCCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)n1
InChIInChI=1S/C21H34N4O3/c1-2-7-18-23-20(28-24-18)11-6-10-19(26)22-17-12-14-25(15-13-17)21(27)16-8-4-3-5-9-16/h16-17H,2-15H2,1H3,(H,22,26)
InChIKeyZFOKIYKRPFUCLZ-UHFFFAOYSA-N
XLogP3.03
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.53
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 4-[4-(3-propyl-1,2,4-oxadiazol-5-yl)butanoylamino]piperidine-1-carboxylate
CID 55821563
N-(8-azabicyclo[3.2.1]octan-3-yl)-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide
CID 119458881
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 55690877
cis-(1R,3S)-3-[3-(3-propyl-1,2,4-oxadiazol-5-yl)propanoylamino]cyclopentane-1-carboxylic acid
CID 106320037
N-[(1R,2R)-2-methylcyclohexyl]-3-(3-propyl-1,2,4-oxadiazol-5-yl)propanamide
CID 94811051
ethyl 4-[[1-(cyclohexanecarbonyl)piperidin-4-yl]amino]-4-oxobutanoate
CID 108563869
N-[4-[[1-(cyclohexanecarbonyl)piperidin-4-yl]amino]-4-oxobutyl]-2,2-dimethylpropanamide
CID 55706617
3-amino-N-[[1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)butanoyl]piperidin-2-yl]methyl]propanamide
CID 120579941
N-(1-cyclohexylbenzimidazol-2-yl)-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide
CID 55854386
N-[1-(4-ethoxybenzoyl)piperidin-4-yl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 112834506
2-chloro-N-[1-(cyclohexanecarbonyl)piperidin-4-yl]acetamide
CID 50988896
morpholin-4-yl-[1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]methanone
CID 56706828

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide?
The IUPAC name of N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide (CID 55838480) is N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide.
What is the SMILES notation for N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide?
The canonical SMILES for N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide is CCCc1noc(CCCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)n1.
What is the InChIKey of N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide?
The InChIKey is ZFOKIYKRPFUCLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H34N4O3/c1-2-7-18-23-20(28-24-18)11-6-10-19(26)22-17-12-14-25(15-13-17)21(27)16-8-4-3-5-9-16/h16-17H,2-15H2,1H3,(H,22,26).
What are the key properties of N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide?
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide has a molecular weight of 390.53 g/mol, XLogP of 3.03, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide is sourced from PubChem (CID 55838480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).