2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide

C15H23N3O2 — CID 108922247

IUPAC2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide
SMILESN#CCC(=O)NCC1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C15H23N3O2/c16-8-5-14(19)17-11-12-6-9-18(10-7-12)15(20)13-3-1-2-4-13/h12-13H,1-7,9-11H2,(H,17,19)
InChIKeyLUZUOENLSZWNSN-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.45
Rot. Bonds4

About 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide

2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide (PubChem CID 108922247) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound Name2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide
PubChem CID108922247
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide
SMILESN#CCC(=O)NCC1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C15H23N3O2/c16-8-5-14(19)17-11-12-6-9-18(10-7-12)15(20)13-3-1-2-4-13/h12-13H,1-7,9-11H2,(H,17,19)
InChIKeyLUZUOENLSZWNSN-UHFFFAOYSA-N
XLogP1.45
TPSA73.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide (CID 108922247) is 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide is N#CCC(=O)NCC1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide?
The InChIKey is LUZUOENLSZWNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c16-8-5-14(19)17-11-12-6-9-18(10-7-12)15(20)13-3-1-2-4-13/h12-13H,1-7,9-11H2,(H,17,19).
What are the key properties of 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide?
2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-[[1-(cyclopentanecarbonyl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 108922247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).