N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide

C16H23N5O — CID 51104474

IUPACN-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
SMILESN#CC1(NC(=O)CN2CCC(c3ccn[nH]3)CC2)CCCC1
InChIInChI=1S/C16H23N5O/c17-12-16(6-1-2-7-16)19-15(22)11-21-9-4-13(5-10-21)14-3-8-18-20-14/h3,8,13H,1-2,4-7,9-11H2,(H,18,20)(H,19,22)
InChIKeyCPEYBBKRCMCBRD-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.54
Rot. Bonds4

About N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide

N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide (PubChem CID 51104474) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
PubChem CID51104474
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC NameN-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
SMILESN#CC1(NC(=O)CN2CCC(c3ccn[nH]3)CC2)CCCC1
InChIInChI=1S/C16H23N5O/c17-12-16(6-1-2-7-16)19-15(22)11-21-9-4-13(5-10-21)14-3-8-18-20-14/h3,8,13H,1-2,4-7,9-11H2,(H,18,20)(H,19,22)
InChIKeyCPEYBBKRCMCBRD-UHFFFAOYSA-N
XLogP1.54
TPSA84.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.54
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-benzyl-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104503
N-(1-cyanocyclopentyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 78787236
N-(1-cyanocyclohexyl)-2-(4-ethylpiperidin-1-yl)acetamide
CID 47281127
1-[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134533
N-[(3S)-1,1-dioxothiolan-3-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 94819756
2-[4-[acetyl(methyl)amino]piperidin-1-yl]-N-(1-cyanocyclohexyl)acetamide
CID 48736687
N-(1-cyanocyclopentyl)-2-[4-(7-ethyl-1H-indol-3-yl)piperidin-1-yl]acetamide
CID 87030920
N-(1-cyanocyclopentyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide
CID 4824530
2-(4-benzoylpiperazin-1-yl)-N-(1-cyanocyclopentyl)acetamide
CID 4782285
N-(1-cyanocyclopentyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
CID 34944552
N-(2-cyanoethyl)-N-methyl-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104425

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide (CID 51104474) is N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide is N#CC1(NC(=O)CN2CCC(c3ccn[nH]3)CC2)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?
The InChIKey is CPEYBBKRCMCBRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c17-12-16(6-1-2-7-16)19-15(22)11-21-9-4-13(5-10-21)14-3-8-18-20-14/h3,8,13H,1-2,4-7,9-11H2,(H,18,20)(H,19,22).
What are the key properties of N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?
N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide has a molecular weight of 301.39 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 51104474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).