N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide

C13H22N2O3 — CID 111471342

IUPACN-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESO=C(CN1CCCCC1=O)NCC1CCCC1O
InChIInChI=1S/C13H22N2O3/c16-11-5-3-4-10(11)8-14-12(17)9-15-7-2-1-6-13(15)18/h10-11,16H,1-9H2,(H,14,17)
InChIKeyANPNGDSYNHULBK-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.28
Rot. Bonds4

About N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide

N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide (PubChem CID 111471342) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
PubChem CID111471342
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC NameN-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESO=C(CN1CCCCC1=O)NCC1CCCC1O
InChIInChI=1S/C13H22N2O3/c16-11-5-3-4-10(11)8-14-12(17)9-15-7-2-1-6-13(15)18/h10-11,16H,1-9H2,(H,14,17)
InChIKeyANPNGDSYNHULBK-UHFFFAOYSA-N
XLogP0.28
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The IUPAC name of N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide (CID 111471342) is N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The canonical SMILES for N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide is O=C(CN1CCCCC1=O)NCC1CCCC1O.
What is the InChIKey of N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The InChIKey is ANPNGDSYNHULBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c16-11-5-3-4-10(11)8-14-12(17)9-15-7-2-1-6-13(15)18/h10-11,16H,1-9H2,(H,14,17).
What are the key properties of N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide has a molecular weight of 254.33 g/mol, XLogP of 0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide is sourced from PubChem (CID 111471342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).