N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide

C12H18N4O3 — CID 102791065

IUPACN-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide
SMILESCCNC1COCC1c1nc(C(=O)NC2CC2)no1
InChIInChI=1S/C12H18N4O3/c1-2-13-9-6-18-5-8(9)12-15-10(16-19-12)11(17)14-7-3-4-7/h7-9,13H,2-6H2,1H3,(H,14,17)
InChIKeyLTHNFDGNLYTLMO-UHFFFAOYSA-N
MW266.30 g/mol
LogP0.05
Rot. Bonds5

About N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide

N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide (PubChem CID 102791065) has the molecular formula C12H18N4O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide
PubChem CID102791065
Molecular FormulaC12H18N4O3
Molecular Weight266.30 g/mol
Exact Mass266.14
IUPAC NameN-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide
SMILESCCNC1COCC1c1nc(C(=O)NC2CC2)no1
InChIInChI=1S/C12H18N4O3/c1-2-13-9-6-18-5-8(9)12-15-10(16-19-12)11(17)14-7-3-4-7/h7-9,13H,2-6H2,1H3,(H,14,17)
InChIKeyLTHNFDGNLYTLMO-UHFFFAOYSA-N
XLogP0.05
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)oxolan-3-amine
CID 66248052
5-(2-cyanocyclopropyl)-N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide
CID 106527873
N-ethyl-4-[3-(oxolan-2-yl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 66246873
N-ethyl-4-[3-(3,3,3-trifluoropropyl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 79953397
4-[3-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-5-yl]-N-ethyloxolan-3-amine
CID 66246266
N-cyclopropyl-5-piperidin-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 102790751
N-ethyl-4-[3-(phenylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 66246672
4-[3-[2-(2,2-difluoroethoxy)ethyl]-1,2,4-oxadiazol-5-yl]-N-ethyloxolan-3-amine
CID 103146456
5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791399
N-propyl-4-[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 82007546
N-ethyl-4-[3-(4-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 66245091
N-cyclopropyl-5-[1-(2-hydroxyethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129001579

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide (CID 102791065) is N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide is CCNC1COCC1c1nc(C(=O)NC2CC2)no1.
What is the InChIKey of N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is LTHNFDGNLYTLMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3/c1-2-13-9-6-18-5-8(9)12-15-10(16-19-12)11(17)14-7-3-4-7/h7-9,13H,2-6H2,1H3,(H,14,17).
What are the key properties of N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide?
N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-[4-(ethylamino)oxolan-3-yl]-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 102791065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).