N-(1-cyanocyclooctyl)furan-2-carboxamide

C14H18N2O2 — CID 54904517

IUPACN-(1-cyanocyclooctyl)furan-2-carboxamide
SMILESN#CC1(NC(=O)c2ccco2)CCCCCCC1
InChIInChI=1S/C14H18N2O2/c15-11-14(8-4-2-1-3-5-9-14)16-13(17)12-7-6-10-18-12/h6-7,10H,1-5,8-9H2,(H,16,17)
InChIKeyHZDWEKAPJLDNQA-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.02
Rot. Bonds2

About N-(1-cyanocyclooctyl)furan-2-carboxamide

N-(1-cyanocyclooctyl)furan-2-carboxamide (PubChem CID 54904517) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-(1-cyanocyclooctyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(1-cyanocyclooctyl)furan-2-carboxamide
PubChem CID54904517
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN-(1-cyanocyclooctyl)furan-2-carboxamide
SMILESN#CC1(NC(=O)c2ccco2)CCCCCCC1
InChIInChI=1S/C14H18N2O2/c15-11-14(8-4-2-1-3-5-9-14)16-13(17)12-7-6-10-18-12/h6-7,10H,1-5,8-9H2,(H,16,17)
InChIKeyHZDWEKAPJLDNQA-UHFFFAOYSA-N
XLogP3.02
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2S)-1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] furan-2-carboxylate
CID 7814385
N-(1-cyanocycloheptyl)furan-3-carboxamide
CID 54904387
1-(furan-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 43151464
N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide
CID 60704628
[2-[(1-cyanocycloheptyl)amino]-2-oxoethyl] 2-(furan-2-carbonylamino)-3-methylbenzoate
CID 18206151
N-(1-cyanocycloheptyl)-5-ethylfuran-2-carboxamide
CID 112731234
N-(1-cyanocyclohexyl)-4-hydroxybenzamide
CID 60717123
N-[(1-hydroxycyclohexyl)methyl]furan-2-carboxamide
CID 64866996
N-[3-[2-[(1-cyanocyclobutyl)amino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 71935882
N-(1-cyanocyclooctyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 60968675
2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide
CID 106685763
N-(1-cyanocyclooctyl)-3-fluorobenzamide
CID 60968532

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclooctyl)furan-2-carboxamide?
The IUPAC name of N-(1-cyanocyclooctyl)furan-2-carboxamide (CID 54904517) is N-(1-cyanocyclooctyl)furan-2-carboxamide.
What is the SMILES notation for N-(1-cyanocyclooctyl)furan-2-carboxamide?
The canonical SMILES for N-(1-cyanocyclooctyl)furan-2-carboxamide is N#CC1(NC(=O)c2ccco2)CCCCCCC1.
What is the InChIKey of N-(1-cyanocyclooctyl)furan-2-carboxamide?
The InChIKey is HZDWEKAPJLDNQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c15-11-14(8-4-2-1-3-5-9-14)16-13(17)12-7-6-10-18-12/h6-7,10H,1-5,8-9H2,(H,16,17).
What are the key properties of N-(1-cyanocyclooctyl)furan-2-carboxamide?
N-(1-cyanocyclooctyl)furan-2-carboxamide has a molecular weight of 246.31 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclooctyl)furan-2-carboxamide is sourced from PubChem (CID 54904517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).