N-[1-(propanoylamino)piperidin-3-yl]propanamide

C11H21N3O2 — CID 67630103

IUPACN-[1-(propanoylamino)piperidin-3-yl]propanamide
SMILESCCC(=O)NC1CCCN(NC(=O)CC)C1
InChIInChI=1S/C11H21N3O2/c1-3-10(15)12-9-6-5-7-14(8-9)13-11(16)4-2/h9H,3-8H2,1-2H3,(H,12,15)(H,13,16)
InChIKeyJCBLLXBNZVTZEO-UHFFFAOYSA-N
MW227.31 g/mol
LogP0.42
Rot. Bonds4

About N-[1-(propanoylamino)piperidin-3-yl]propanamide

N-[1-(propanoylamino)piperidin-3-yl]propanamide (PubChem CID 67630103) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-[1-(propanoylamino)piperidin-3-yl]propanamide.

Molecular Properties

Compound NameN-[1-(propanoylamino)piperidin-3-yl]propanamide
PubChem CID67630103
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN-[1-(propanoylamino)piperidin-3-yl]propanamide
SMILESCCC(=O)NC1CCCN(NC(=O)CC)C1
InChIInChI=1S/C11H21N3O2/c1-3-10(15)12-9-6-5-7-14(8-9)13-11(16)4-2/h9H,3-8H2,1-2H3,(H,12,15)(H,13,16)
InChIKeyJCBLLXBNZVTZEO-UHFFFAOYSA-N
XLogP0.42
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(propanoylamino)piperidin-3-yl]propanamide?
The IUPAC name of N-[1-(propanoylamino)piperidin-3-yl]propanamide (CID 67630103) is N-[1-(propanoylamino)piperidin-3-yl]propanamide.
What is the SMILES notation for N-[1-(propanoylamino)piperidin-3-yl]propanamide?
The canonical SMILES for N-[1-(propanoylamino)piperidin-3-yl]propanamide is CCC(=O)NC1CCCN(NC(=O)CC)C1.
What is the InChIKey of N-[1-(propanoylamino)piperidin-3-yl]propanamide?
The InChIKey is JCBLLXBNZVTZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-3-10(15)12-9-6-5-7-14(8-9)13-11(16)4-2/h9H,3-8H2,1-2H3,(H,12,15)(H,13,16).
What are the key properties of N-[1-(propanoylamino)piperidin-3-yl]propanamide?
N-[1-(propanoylamino)piperidin-3-yl]propanamide has a molecular weight of 227.31 g/mol, XLogP of 0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(propanoylamino)piperidin-3-yl]propanamide is sourced from PubChem (CID 67630103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).