N-cyclooctyl-5-oxo-5-phenylpentanamide

C19H27NO2 — CID 20969095

IUPACN-cyclooctyl-5-oxo-5-phenylpentanamide
SMILESO=C(CCCC(=O)c1ccccc1)NC1CCCCCCC1
InChIInChI=1S/C19H27NO2/c21-18(16-10-5-4-6-11-16)14-9-15-19(22)20-17-12-7-2-1-3-8-13-17/h4-6,10-11,17H,1-3,7-9,12-15H2,(H,20,22)
InChIKeyVXRZJAOYPZCNSB-UHFFFAOYSA-N
MW301.43 g/mol
LogP4.27
Rot. Bonds6

About N-cyclooctyl-5-oxo-5-phenylpentanamide

N-cyclooctyl-5-oxo-5-phenylpentanamide (PubChem CID 20969095) has the molecular formula C19H27NO2 and a molecular weight of 301.43 g/mol. Its IUPAC name is N-cyclooctyl-5-oxo-5-phenylpentanamide.

Molecular Properties

Compound NameN-cyclooctyl-5-oxo-5-phenylpentanamide
PubChem CID20969095
Molecular FormulaC19H27NO2
Molecular Weight301.43 g/mol
Exact Mass301.20
IUPAC NameN-cyclooctyl-5-oxo-5-phenylpentanamide
SMILESO=C(CCCC(=O)c1ccccc1)NC1CCCCCCC1
InChIInChI=1S/C19H27NO2/c21-18(16-10-5-4-6-11-16)14-9-15-19(22)20-17-12-7-2-1-3-8-13-17/h4-6,10-11,17H,1-3,7-9,12-15H2,(H,20,22)
InChIKeyVXRZJAOYPZCNSB-UHFFFAOYSA-N
XLogP4.27
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(cyclopentylamino)-3-oxopropyl]-4-oxo-4-phenylbutanamide
CID 26721985
5-oxo-N-(oxolan-3-yl)-5-phenylpentanamide
CID 86287240
N-[(1S,3aS,6aS)-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl]-5-oxo-5-phenylpentanamide
CID 70745414
1-cyclohexyl-3-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]urea
CID 12940306
N-cycloheptyl-4-(4-methylphenyl)-4-oxobutanamide
CID 26711840
N-cyclopentyl-2-phenacylsulfanylacetamide
CID 126798493
4-(3-aminophenyl)-N-cyclohexyl-4-oxobutanamide
CID 94283308
5-oxo-N-[3-(6-oxo-1H-pyrimidin-4-yl)cyclobutyl]-5-phenylpentanamide
CID 136664872
5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide
CID 131905750
N-(4-morpholin-4-yl-4-phenylcyclohexyl)-5-oxo-5-phenylpentanamide
CID 11669235
N-cyclopentyl-4-(2,4-dioxo-1-phenacylquinazolin-3-yl)butanamide
CID 6619275
N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-5-oxo-5-phenylpentanamide?
The IUPAC name of N-cyclooctyl-5-oxo-5-phenylpentanamide (CID 20969095) is N-cyclooctyl-5-oxo-5-phenylpentanamide.
What is the SMILES notation for N-cyclooctyl-5-oxo-5-phenylpentanamide?
The canonical SMILES for N-cyclooctyl-5-oxo-5-phenylpentanamide is O=C(CCCC(=O)c1ccccc1)NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-5-oxo-5-phenylpentanamide?
The InChIKey is VXRZJAOYPZCNSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO2/c21-18(16-10-5-4-6-11-16)14-9-15-19(22)20-17-12-7-2-1-3-8-13-17/h4-6,10-11,17H,1-3,7-9,12-15H2,(H,20,22).
What are the key properties of N-cyclooctyl-5-oxo-5-phenylpentanamide?
N-cyclooctyl-5-oxo-5-phenylpentanamide has a molecular weight of 301.43 g/mol, XLogP of 4.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-5-oxo-5-phenylpentanamide is sourced from PubChem (CID 20969095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).