N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide

C14H23N3O2 — CID 115874111

IUPACN-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide
SMILESCC1(O)CCCN(CC(=O)NC2(C#N)CCCC2)C1
InChIInChI=1S/C14H23N3O2/c1-13(19)5-4-8-17(11-13)9-12(18)16-14(10-15)6-2-3-7-14/h19H,2-9,11H2,1H3,(H,16,18)
InChIKeyGHHCPOVRTCODLW-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.79
Rot. Bonds3

About N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide

N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide (PubChem CID 115874111) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide
PubChem CID115874111
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide
SMILESCC1(O)CCCN(CC(=O)NC2(C#N)CCCC2)C1
InChIInChI=1S/C14H23N3O2/c1-13(19)5-4-8-17(11-13)9-12(18)16-14(10-15)6-2-3-7-14/h19H,2-9,11H2,1H3,(H,16,18)
InChIKeyGHHCPOVRTCODLW-UHFFFAOYSA-N
XLogP0.79
TPSA76.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide
CID 2472458
N-(1-cyanocyclopentyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 78787236
N-(1-cyanocyclopentyl)-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 8903348
N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62547397
N-(1-cyanocyclohexyl)-2-piperazin-1-ylacetamide
CID 43090468
N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide
CID 47104633
N-(1-cyanocyclohexyl)-2-(1,4-diazepan-1-yl)acetamide
CID 43340980
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-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide
CID 8899292
N-(1-cyanocycloheptyl)-2-[(3R)-3-methylpiperazin-1-yl]acetamide
CID 104975491
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(1-cyanocyclohexyl)acetamide
CID 113282484

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide (CID 115874111) is N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide is CC1(O)CCCN(CC(=O)NC2(C#N)CCCC2)C1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide?
The InChIKey is GHHCPOVRTCODLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-13(19)5-4-8-17(11-13)9-12(18)16-14(10-15)6-2-3-7-14/h19H,2-9,11H2,1H3,(H,16,18).
What are the key properties of N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide?
N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide has a molecular weight of 265.36 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 115874111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).