2-(2-cyanocycloheptyl)oxybenzamide

C15H18N2O2 — CID 43292463

IUPAC2-(2-cyanocycloheptyl)oxybenzamide
SMILESN#CC1CCCCCC1Oc1ccccc1C(N)=O
InChIInChI=1S/C15H18N2O2/c16-10-11-6-2-1-3-8-13(11)19-14-9-5-4-7-12(14)15(17)18/h4-5,7,9,11,13H,1-3,6,8H2,(H2,17,18)
InChIKeyJIQBETOTYOGFHR-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.64
Rot. Bonds3

About 2-(2-cyanocycloheptyl)oxybenzamide

2-(2-cyanocycloheptyl)oxybenzamide (PubChem CID 43292463) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(2-cyanocycloheptyl)oxybenzamide.

Molecular Properties

Compound Name2-(2-cyanocycloheptyl)oxybenzamide
PubChem CID43292463
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-(2-cyanocycloheptyl)oxybenzamide
SMILESN#CC1CCCCCC1Oc1ccccc1C(N)=O
InChIInChI=1S/C15H18N2O2/c16-10-11-6-2-1-3-8-13(11)19-14-9-5-4-7-12(14)15(17)18/h4-5,7,9,11,13H,1-3,6,8H2,(H2,17,18)
InChIKeyJIQBETOTYOGFHR-UHFFFAOYSA-N
XLogP2.64
TPSA76.11 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-aminophenoxy)cyclohexane-1-carbonitrile
CID 117095468
2-(2-chlorophenoxy)cyclohexane-1-carbonitrile
CID 43292272
5-amino-2-(2-cyanocyclohexyl)oxybenzoic acid
CID 117096013
2-(2-cyanocyclohexyl)oxy-3-methoxybenzoic acid
CID 117054033
2-(2-propan-2-ylphenoxy)cyclohexane-1-carbonitrile
CID 43292426
2-(2-bromophenoxy)cyclopentane-1-carbonitrile
CID 43292592
2-(2-cyanocyclopentyl)oxybenzonitrile
CID 43292568
2-(2-ethylphenoxy)cyclopentane-1-carbonitrile
CID 43292906
2-(2,4,5-trichlorophenoxy)cyclohexane-1-carbonitrile
CID 43292539
2-(oxetan-2-yloxy)benzamide
CID 172814860
2-(2-aminocyclopentyl)oxybenzoic acid
CID 117053950
2-[2-(dimethylamino)cyclohexyl]oxybenzoic acid
CID 82037587

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanocycloheptyl)oxybenzamide?
The IUPAC name of 2-(2-cyanocycloheptyl)oxybenzamide (CID 43292463) is 2-(2-cyanocycloheptyl)oxybenzamide.
What is the SMILES notation for 2-(2-cyanocycloheptyl)oxybenzamide?
The canonical SMILES for 2-(2-cyanocycloheptyl)oxybenzamide is N#CC1CCCCCC1Oc1ccccc1C(N)=O.
What is the InChIKey of 2-(2-cyanocycloheptyl)oxybenzamide?
The InChIKey is JIQBETOTYOGFHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c16-10-11-6-2-1-3-8-13(11)19-14-9-5-4-7-12(14)15(17)18/h4-5,7,9,11,13H,1-3,6,8H2,(H2,17,18).
What are the key properties of 2-(2-cyanocycloheptyl)oxybenzamide?
2-(2-cyanocycloheptyl)oxybenzamide has a molecular weight of 258.32 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanocycloheptyl)oxybenzamide is sourced from PubChem (CID 43292463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).