N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide

C13H25N3O2 — CID 54923747

IUPACN-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide
SMILESCC(C)CCC(=O)N(CC(N)=O)C1CCNCC1
InChIInChI=1S/C13H25N3O2/c1-10(2)3-4-13(18)16(9-12(14)17)11-5-7-15-8-6-11/h10-11,15H,3-9H2,1-2H3,(H2,14,17)
InChIKeyIABVNASYVBZHCH-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.49
Rot. Bonds6

About N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide

N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide (PubChem CID 54923747) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide
PubChem CID54923747
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide
SMILESCC(C)CCC(=O)N(CC(N)=O)C1CCNCC1
InChIInChI=1S/C13H25N3O2/c1-10(2)3-4-13(18)16(9-12(14)17)11-5-7-15-8-6-11/h10-11,15H,3-9H2,1-2H3,(H2,14,17)
InChIKeyIABVNASYVBZHCH-UHFFFAOYSA-N
XLogP0.49
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide (CID 54923747) is N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide is CC(C)CCC(=O)N(CC(N)=O)C1CCNCC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide?
The InChIKey is IABVNASYVBZHCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-10(2)3-4-13(18)16(9-12(14)17)11-5-7-15-8-6-11/h10-11,15H,3-9H2,1-2H3,(H2,14,17).
What are the key properties of N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide?
N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide has a molecular weight of 255.36 g/mol, XLogP of 0.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-4-methyl-N-piperidin-4-ylpentanamide is sourced from PubChem (CID 54923747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).