2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide

C13H25N3O2 — CID 113263956

IUPAC2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide
SMILESCCCC(N)C(=O)NCCC(=O)N1CCCCC1
InChIInChI=1S/C13H25N3O2/c1-2-6-11(14)13(18)15-8-7-12(17)16-9-4-3-5-10-16/h11H,2-10,14H2,1H3,(H,15,18)
InChIKeyWRGHDTPSEKLBHE-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.63
Rot. Bonds6

About 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide

2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide (PubChem CID 113263956) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide.

Molecular Properties

Compound Name2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide
PubChem CID113263956
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide
SMILESCCCC(N)C(=O)NCCC(=O)N1CCCCC1
InChIInChI=1S/C13H25N3O2/c1-2-6-11(14)13(18)15-8-7-12(17)16-9-4-3-5-10-16/h11H,2-10,14H2,1H3,(H,15,18)
InChIKeyWRGHDTPSEKLBHE-UHFFFAOYSA-N
XLogP0.63
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 ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3-oxo-3-pyrrolidin-1-ylpropyl)butanediamide
CID 61248901
2-amino-3-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide
CID 115738343
5-amino-2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide
CID 104685586
2-bromo-N-(3-oxo-3-piperidin-1-ylpropyl)propanamide
CID 107905705
4-amino-2-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)butanamide
CID 80543621
4-(aminomethyl)-1-(azepan-1-yl)heptan-1-one
CID 112515748
3-(2-methylpentylamino)-1-piperidin-1-ylpropan-1-one
CID 112554126
2-chloro-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
CID 61251378
2-amino-N-propylpentanamide
CID 43649977
2-amino-1-(azocan-1-yl)pentan-1-one;hydrochloride
CID 119264220
N-(3-oxo-3-piperidin-1-ylpropyl)pyrrolidine-1-carboxamide
CID 115583806
3-(2-methylpentylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 43203515

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide?
The IUPAC name of 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide (CID 113263956) is 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide.
What is the SMILES notation for 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide?
The canonical SMILES for 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide is CCCC(N)C(=O)NCCC(=O)N1CCCCC1.
What is the InChIKey of 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide?
The InChIKey is WRGHDTPSEKLBHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-2-6-11(14)13(18)15-8-7-12(17)16-9-4-3-5-10-16/h11H,2-10,14H2,1H3,(H,15,18).
What are the key properties of 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide?
2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide has a molecular weight of 255.36 g/mol, XLogP of 0.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-oxo-3-piperidin-1-ylpropyl)pentanamide is sourced from PubChem (CID 113263956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).