N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide

C13H21N3O2 — CID 47104633

IUPACN-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide
SMILESN#CC1(NC(=O)CN2CCCC(O)C2)CCCC1
InChIInChI=1S/C13H21N3O2/c14-10-13(5-1-2-6-13)15-12(18)9-16-7-3-4-11(17)8-16/h11,17H,1-9H2,(H,15,18)
InChIKeyUNIYQRRWSAFMOA-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.40
Rot. Bonds3

About N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide

N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide (PubChem CID 47104633) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide
PubChem CID47104633
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC NameN-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide
SMILESN#CC1(NC(=O)CN2CCCC(O)C2)CCCC1
InChIInChI=1S/C13H21N3O2/c14-10-13(5-1-2-6-13)15-12(18)9-16-7-3-4-11(17)8-16/h11,17H,1-9H2,(H,15,18)
InChIKeyUNIYQRRWSAFMOA-UHFFFAOYSA-N
XLogP0.40
TPSA76.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyanocyclohexyl)-2-[(3S)-3-hydroxypiperidin-1-yl]acetamide
CID 51980802
N-(1-cyanocyclopentyl)-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 8903348
N-(1-cyanocyclopentyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62547397
2-(azocan-1-yl)-N-(1-cyanocyclopentyl)acetamide
CID 2472458
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(1-cyanocyclohexyl)acetamide
CID 113282484
2-(4-amino-3-methylpiperidin-1-yl)-N-(1-cyanocyclohexyl)acetamide
CID 79867740
N-(1-cyanocycloheptyl)-2-[(3R)-3-methylpiperazin-1-yl]acetamide
CID 104975491
N-(1-cyanocyclohexyl)-2-(4-ethylpiperidin-1-yl)acetamide
CID 47281127
N-(cyanomethyl)-2-(3-hydroxypiperidin-1-yl)acetamide
CID 62022097
N-(1-cyanocyclopentyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 78787236
N-(1-cyanocyclopentyl)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide
CID 8899292
N-(1-cyanocyclohexyl)-2-piperazin-1-ylacetamide
CID 43090468

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide (CID 47104633) is N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide is N#CC1(NC(=O)CN2CCCC(O)C2)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide?
The InChIKey is UNIYQRRWSAFMOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c14-10-13(5-1-2-6-13)15-12(18)9-16-7-3-4-11(17)8-16/h11,17H,1-9H2,(H,15,18).
What are the key properties of N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide?
N-(1-cyanocyclopentyl)-2-(3-hydroxypiperidin-1-yl)acetamide has a molecular weight of 251.33 g/mol, XLogP of 0.40, 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-hydroxypiperidin-1-yl)acetamide is sourced from PubChem (CID 47104633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).