3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide

C17H31N3O2 — CID 119555898

IUPAC3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide
SMILESO=C(CCC1CCCC1)NCC(=O)NCCC1CCCNC1
InChIInChI=1S/C17H31N3O2/c21-16(8-7-14-4-1-2-5-14)20-13-17(22)19-11-9-15-6-3-10-18-12-15/h14-15,18H,1-13H2,(H,19,22)(H,20,21)
InChIKeyKAZVVGTYLQUSAL-UHFFFAOYSA-N
MW309.45 g/mol
LogP1.58
Rot. Bonds8

About 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide

3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide (PubChem CID 119555898) has the molecular formula C17H31N3O2 and a molecular weight of 309.45 g/mol. Its IUPAC name is 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide
PubChem CID119555898
Molecular FormulaC17H31N3O2
Molecular Weight309.45 g/mol
Exact Mass309.24
IUPAC Name3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide
SMILESO=C(CCC1CCCC1)NCC(=O)NCCC1CCCNC1
InChIInChI=1S/C17H31N3O2/c21-16(8-7-14-4-1-2-5-14)20-13-17(22)19-11-9-15-6-3-10-18-12-15/h14-15,18H,1-13H2,(H,19,22)(H,20,21)
InChIKeyKAZVVGTYLQUSAL-UHFFFAOYSA-N
XLogP1.58
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.45
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide (CID 119555898) is 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide is O=C(CCC1CCCC1)NCC(=O)NCCC1CCCNC1.
What is the InChIKey of 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide?
The InChIKey is KAZVVGTYLQUSAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3O2/c21-16(8-7-14-4-1-2-5-14)20-13-17(22)19-11-9-15-6-3-10-18-12-15/h14-15,18H,1-13H2,(H,19,22)(H,20,21).
What are the key properties of 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide?
3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide has a molecular weight of 309.45 g/mol, XLogP of 1.58, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide is sourced from PubChem (CID 119555898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).