2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide

C15H25N3O — CID 2472458

IUPAC2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide
SMILESN#CC1(NC(=O)CN2CCCCCCC2)CCCC1
InChIInChI=1S/C15H25N3O/c16-13-15(8-4-5-9-15)17-14(19)12-18-10-6-2-1-3-7-11-18/h1-12H2,(H,17,19)
InChIKeyOLXLECHOSJPKAP-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.21
Rot. Bonds3

About 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide

2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide (PubChem CID 2472458) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide.

Molecular Properties

Compound Name2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide
PubChem CID2472458
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide
SMILESN#CC1(NC(=O)CN2CCCCCCC2)CCCC1
InChIInChI=1S/C15H25N3O/c16-13-15(8-4-5-9-15)17-14(19)12-18-10-6-2-1-3-7-11-18/h1-12H2,(H,17,19)
InChIKeyOLXLECHOSJPKAP-UHFFFAOYSA-N
XLogP2.21
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyanocyclohexyl)-2-piperazin-1-ylacetamide
CID 43090468
N-(1-cyanocyclohexyl)-2-(1,4-diazepan-1-yl)acetamide
CID 43340980
N-(1-cyanocyclopentyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 78787236
N-(1-cyanocyclohexyl)-2-[(3S)-3-hydroxypiperidin-1-yl]acetamide
CID 51980802
N-(1-cyanocyclohexyl)-2-(4-ethylpiperidin-1-yl)acetamide
CID 47281127
N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide
CID 47104633
N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide
CID 115874111
N-(1-cyanocyclohexyl)-2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]acetamide
CID 18208029
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(1-cyanocyclohexyl)acetamide
CID 113282484
N-(1-cyanocyclopentyl)-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 8903348
2-[4-[acetyl(methyl)amino]piperidin-1-yl]-N-(1-cyanocyclohexyl)acetamide
CID 48736687
N-(1-cyanocycloheptyl)-2-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]acetamide
CID 52675624

Frequently Asked Questions

What is the IUPAC name of 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide?
The IUPAC name of 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide (CID 2472458) is 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide.
What is the SMILES notation for 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide?
The canonical SMILES for 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide is N#CC1(NC(=O)CN2CCCCCCC2)CCCC1.
What is the InChIKey of 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide?
The InChIKey is OLXLECHOSJPKAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c16-13-15(8-4-5-9-15)17-14(19)12-18-10-6-2-1-3-7-11-18/h1-12H2,(H,17,19).
What are the key properties of 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide?
2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide is sourced from PubChem (CID 2472458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).