N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide

C14H15F2N3O3 — CID 122245423

IUPACN-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide
SMILESO=C(NCc1nc(C2CCC(F)(F)CC2)no1)c1ccco1
InChIInChI=1S/C14H15F2N3O3/c15-14(16)5-3-9(4-6-14)12-18-11(22-19-12)8-17-13(20)10-2-1-7-21-10/h1-2,7,9H,3-6,8H2,(H,17,20)
InChIKeyFSUVUICSCUJFTK-UHFFFAOYSA-N
MW311.29 g/mol
LogP2.89
Rot. Bonds4

About N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide

N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide (PubChem CID 122245423) has the molecular formula C14H15F2N3O3 and a molecular weight of 311.29 g/mol. Its IUPAC name is N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide
PubChem CID122245423
Molecular FormulaC14H15F2N3O3
Molecular Weight311.29 g/mol
Exact Mass311.11
IUPAC NameN-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide
SMILESO=C(NCc1nc(C2CCC(F)(F)CC2)no1)c1ccco1
InChIInChI=1S/C14H15F2N3O3/c15-14(16)5-3-9(4-6-14)12-18-11(22-19-12)8-17-13(20)10-2-1-7-21-10/h1-2,7,9H,3-6,8H2,(H,17,20)
InChIKeyFSUVUICSCUJFTK-UHFFFAOYSA-N
XLogP2.89
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.29
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide with MolForge

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Related Compounds

N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(4-fluorophenyl)sulfanylacetamide
CID 122245433
N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]-1,3,5-trimethylpyrazole-4-carboxamide
CID 122245475
N-[[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)thiophen-2-yl]methyl]furan-2-carboxamide
CID 53156179
3-(furan-2-yl)-N-[[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl]prop-2-enamide
CID 171136875
5-bromo-N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]pyrimidin-2-amine
CID 126853538
N-[(3-cyclohexyl-1,2,4-oxadiazol-5-yl)methyl]-3-(furan-2-yl)-3-phenylpropanamide
CID 131940946
N-[[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide
CID 83278485
2-bromo-N-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4-fluorobenzamide
CID 47063305
N-[(3-cyclohexyl-1,2,4-oxadiazol-5-yl)methyl]-1-methylpyrrole-2-carboxamide
CID 135117057
N-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-5-methyl-2-phenyl-1H-imidazole-4-carboxamide
CID 122566735
N-[[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 121021963
N-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-5-[(4-methylphenyl)sulfanylmethyl]furan-2-carboxamide
CID 135101820

Frequently Asked Questions

What is the IUPAC name of N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide?
The IUPAC name of N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide (CID 122245423) is N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide.
What is the SMILES notation for N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide?
The canonical SMILES for N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide is O=C(NCc1nc(C2CCC(F)(F)CC2)no1)c1ccco1.
What is the InChIKey of N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide?
The InChIKey is FSUVUICSCUJFTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3O3/c15-14(16)5-3-9(4-6-14)12-18-11(22-19-12)8-17-13(20)10-2-1-7-21-10/h1-2,7,9H,3-6,8H2,(H,17,20).
What are the key properties of N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide?
N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide has a molecular weight of 311.29 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide is sourced from PubChem (CID 122245423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).