4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide

C15H20N2O2 — CID 103767150

IUPAC4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide
SMILESN#CC1(C(=O)NC2C3C4CCC(C4)C23)CCOCC1
InChIInChI=1S/C15H20N2O2/c16-8-15(3-5-19-6-4-15)14(18)17-13-11-9-1-2-10(7-9)12(11)13/h9-13H,1-7H2,(H,17,18)
InChIKeyLMLSOWRSYGGAPA-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.47
Rot. Bonds2

About 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide

4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide (PubChem CID 103767150) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide.

Molecular Properties

Compound Name4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide
PubChem CID103767150
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide
SMILESN#CC1(C(=O)NC2C3C4CCC(C4)C23)CCOCC1
InChIInChI=1S/C15H20N2O2/c16-8-15(3-5-19-6-4-15)14(18)17-13-11-9-1-2-10(7-9)12(11)13/h9-13H,1-7H2,(H,17,18)
InChIKeyLMLSOWRSYGGAPA-UHFFFAOYSA-N
XLogP1.47
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bicyclo[2.2.1]heptanyl)-1-cyanocyclopropane-1-carboxamide
CID 80592450
4-cyano-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxane-4-carboxamide
CID 79362624
4-cyano-N-[(2S,3R)-2-(3,4-difluorophenyl)oxolan-3-yl]oxane-4-carboxamide
CID 139021703
N-[(3S,4R)-1-benzyl-4-cyclopropylpyrrolidin-3-yl]-4-cyanooxane-4-carboxamide
CID 133121305
4-cyano-N-[1-(trifluoromethyl)cyclopropyl]oxane-4-carboxamide
CID 103750220
4-cyano-N-[(1-methylcyclopropyl)methyl]oxane-4-carboxamide
CID 103722107
4-cyano-N-piperidin-1-yloxane-4-carboxamide
CID 82843101
4-cyano-N-(3-ethylpentan-3-yl)oxane-4-carboxamide
CID 65043131
4-cyano-N-(3,3-dimethylbutan-2-yl)oxane-4-carboxamide
CID 113234659
4-cyano-N-(3-methyl-2-propan-2-ylbutyl)oxane-4-carboxamide
CID 102906074
4-cyano-N-[(1-methylcyclobutyl)methyl]oxane-4-carboxamide
CID 103737393
1-cyano-N-cyclooctylcyclopentane-1-carboxamide
CID 29240923

Frequently Asked Questions

What is the IUPAC name of 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide?
The IUPAC name of 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide (CID 103767150) is 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide.
What is the SMILES notation for 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide?
The canonical SMILES for 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide is N#CC1(C(=O)NC2C3C4CCC(C4)C23)CCOCC1.
What is the InChIKey of 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide?
The InChIKey is LMLSOWRSYGGAPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c16-8-15(3-5-19-6-4-15)14(18)17-13-11-9-1-2-10(7-9)12(11)13/h9-13H,1-7H2,(H,17,18).
What are the key properties of 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide?
4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-N-(3-tricyclo[3.2.1.02,4]octanyl)oxane-4-carboxamide is sourced from PubChem (CID 103767150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).