N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide

C19H21N5O3 — CID 59594508

IUPACN-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide
SMILESCc1noc(NC(=O)N2CCC(c3nnc(-c4ccccc4)o3)CC2)c1C
InChIInChI=1S/C19H21N5O3/c1-12-13(2)23-27-16(12)20-19(25)24-10-8-15(9-11-24)18-22-21-17(26-18)14-6-4-3-5-7-14/h3-7,15H,8-11H2,1-2H3,(H,20,25)
InChIKeyBVEDCFODOQNUMK-UHFFFAOYSA-N
MW367.41 g/mol
LogP3.75
Rot. Bonds3

About N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide

N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide (PubChem CID 59594508) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide
PubChem CID59594508
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide
SMILESCc1noc(NC(=O)N2CCC(c3nnc(-c4ccccc4)o3)CC2)c1C
InChIInChI=1S/C19H21N5O3/c1-12-13(2)23-27-16(12)20-19(25)24-10-8-15(9-11-24)18-22-21-17(26-18)14-6-4-3-5-7-14/h3-7,15H,8-11H2,1-2H3,(H,20,25)
InChIKeyBVEDCFODOQNUMK-UHFFFAOYSA-N
XLogP3.75
TPSA97.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(3,4-dimethyl-1,2-oxazol-5-yl)carbamoyl]piperazine-1-carboxylic acid
CID 68780628
4-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]-N-naphthalen-1-ylpiperidine-1-carboxamide
CID 121114479
4-(5-methylsulfonyl-1,3,4-oxadiazol-2-yl)-N-phenylpiperidine-1-carboxamide
CID 9189319
N-(2-chlorophenyl)-4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]piperidine-1-carboxamide
CID 90543437
2-methoxy-1-[(3S)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]ethanone
CID 51137734
3-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carbonyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 3314011
2-cyclopentyl-5-phenyl-1,3,4-oxadiazole
CID 83382259
[3-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 75615733
(3S)-N-cyclohexyl-3-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxamide
CID 51137817
4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide
CID 90543429
N-(4-chlorophenyl)-4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide
CID 121114489
phenyl-[(3S)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 92897703

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide (CID 59594508) is N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide is Cc1noc(NC(=O)N2CCC(c3nnc(-c4ccccc4)o3)CC2)c1C.
What is the InChIKey of N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide?
The InChIKey is BVEDCFODOQNUMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-12-13(2)23-27-16(12)20-19(25)24-10-8-15(9-11-24)18-22-21-17(26-18)14-6-4-3-5-7-14/h3-7,15H,8-11H2,1-2H3,(H,20,25).
What are the key properties of N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide?
N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethyl-1,2-oxazol-5-yl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 59594508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).