1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide

C19H26N2O3 — CID 90502974

IUPAC1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide
SMILESCCCCCCCCNC(=O)C1(c2cc(-c3ccco3)on2)CC1
InChIInChI=1S/C19H26N2O3/c1-2-3-4-5-6-7-12-20-18(22)19(10-11-19)17-14-16(24-21-17)15-9-8-13-23-15/h8-9,13-14H,2-7,10-12H2,1H3,(H,20,22)
InChIKeyPOWNHYAUEVLSTA-UHFFFAOYSA-N
MW330.43 g/mol
LogP4.44
Rot. Bonds10

About 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide

1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide (PubChem CID 90502974) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide
PubChem CID90502974
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC Name1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide
SMILESCCCCCCCCNC(=O)C1(c2cc(-c3ccco3)on2)CC1
InChIInChI=1S/C19H26N2O3/c1-2-3-4-5-6-7-12-20-18(22)19(10-11-19)17-14-16(24-21-17)15-9-8-13-23-15/h8-9,13-14H,2-7,10-12H2,1H3,(H,20,22)
InChIKeyPOWNHYAUEVLSTA-UHFFFAOYSA-N
XLogP4.44
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-[2-(2-methylimidazol-1-yl)ethyl]cyclopropane-1-carboxamide
CID 90502761
N-(3-acetamidophenyl)-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropane-1-carboxamide
CID 90502897
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]cyclopropane-1-carboxamide
CID 90502766
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)cyclopropane-1-carboxamide
CID 90502967
N-(2,3-dimethylphenyl)-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropane-1-carboxamide
CID 90502927
1-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(3-methoxypropyl)cyclopropane-1-carboxamide
CID 90503716
N-(3-ethoxypropyl)-1-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]cyclopropane-1-carboxamide
CID 90503720
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-(4-morpholin-4-ylphenyl)cyclopropane-1-carboxamide
CID 90503022
methyl 2-[[1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropanecarbonyl]amino]thiophene-3-carboxylate
CID 90503043
N-[2-(dimethylamino)ethyl]-1-(5-phenyl-1,2-oxazol-3-yl)cyclopropane-1-carboxamide
CID 90503128
1-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(furan-2-ylmethyl)cyclopropane-1-carboxamide
CID 90504356
N-(2,1,3-benzothiadiazol-4-yl)-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropane-1-carboxamide
CID 90502771

Frequently Asked Questions

What is the IUPAC name of 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide?
The IUPAC name of 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide (CID 90502974) is 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide.
What is the SMILES notation for 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide?
The canonical SMILES for 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide is CCCCCCCCNC(=O)C1(c2cc(-c3ccco3)on2)CC1.
What is the InChIKey of 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide?
The InChIKey is POWNHYAUEVLSTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-2-3-4-5-6-7-12-20-18(22)19(10-11-19)17-14-16(24-21-17)15-9-8-13-23-15/h8-9,13-14H,2-7,10-12H2,1H3,(H,20,22).
What are the key properties of 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide?
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 4.44, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide is sourced from PubChem (CID 90502974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).