N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide

C18H24N4O3 — CID 126768794

IUPACN-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide
SMILESCC(NC(=O)c1ccnc(OC2CCC2)c1)c1nc(C(C)(C)C)no1
InChIInChI=1S/C18H24N4O3/c1-11(16-21-17(22-25-16)18(2,3)4)20-15(23)12-8-9-19-14(10-12)24-13-6-5-7-13/h8-11,13H,5-7H2,1-4H3,(H,20,23)
InChIKeyIZRJHCUQEFBFCW-UHFFFAOYSA-N
MW344.42 g/mol
LogP3.18
Rot. Bonds5

About N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide

N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide (PubChem CID 126768794) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide
PubChem CID126768794
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC NameN-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide
SMILESCC(NC(=O)c1ccnc(OC2CCC2)c1)c1nc(C(C)(C)C)no1
InChIInChI=1S/C18H24N4O3/c1-11(16-21-17(22-25-16)18(2,3)4)20-15(23)12-8-9-19-14(10-12)24-13-6-5-7-13/h8-11,13H,5-7H2,1-4H3,(H,20,23)
InChIKeyIZRJHCUQEFBFCW-UHFFFAOYSA-N
XLogP3.18
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2-cyclobutyloxypyridine-4-carbonyl)amino]-2-methyl-3-phenylpropanoic acid
CID 120522196
4-(2-amino-2-oxoethoxy)-N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide
CID 119138870
N-[(1S)-1-[3-(2-cyclopropyloxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 155271733
4-[(2-cyclobutyloxypyridine-4-carbonyl)amino]-4-phenylbutanoic acid
CID 120518914
(2S)-2-[[2-(oxolan-3-yloxy)pyridine-4-carbonyl]amino]propanoic acid
CID 120525990
(2S)-2-[(2-cyclobutyloxypyridine-4-carbonyl)amino]-2-[(3S)-oxan-3-yl]acetic acid
CID 129467997
3-[(2-cyclobutyloxypyridine-4-carbonyl)amino]oxolane-3-carboxylic acid
CID 120532705
[(1S)-1-[3-[2-(3,3-difluorocyclobutyl)oxy-4-pyridinyl]-1,2,4-oxadiazol-5-yl]ethyl]carbamic acid
CID 155272235
2-cyclobutyloxy-N-(5-methyl-1H-indazol-6-yl)pyridine-4-carboxamide
CID 99635967
5-amino-N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-methylbenzamide;hydrochloride
CID 120638330
(2R)-2-amino-N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]propanamide;hydrochloride
CID 119342865
3-amino-N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119817309

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide?
The IUPAC name of N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide (CID 126768794) is N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide.
What is the SMILES notation for N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide?
The canonical SMILES for N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide is CC(NC(=O)c1ccnc(OC2CCC2)c1)c1nc(C(C)(C)C)no1.
What is the InChIKey of N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide?
The InChIKey is IZRJHCUQEFBFCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-11(16-21-17(22-25-16)18(2,3)4)20-15(23)12-8-9-19-14(10-12)24-13-6-5-7-13/h8-11,13H,5-7H2,1-4H3,(H,20,23).
What are the key properties of N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide?
N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]-2-cyclobutyloxypyridine-4-carboxamide is sourced from PubChem (CID 126768794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).