7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide

C14H27N3O2 — CID 115597328

IUPAC7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide
SMILESNCCCCCCC(=O)NCC(=O)N1CCCCC1
InChIInChI=1S/C14H27N3O2/c15-9-5-2-1-4-8-13(18)16-12-14(19)17-10-6-3-7-11-17/h1-12,15H2,(H,16,18)
InChIKeyXEBOWPPOJUXUGR-UHFFFAOYSA-N
MW269.39 g/mol
LogP1.02
Rot. Bonds8

About 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide

7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide (PubChem CID 115597328) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide.

Molecular Properties

Compound Name7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide
PubChem CID115597328
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide
SMILESNCCCCCCC(=O)NCC(=O)N1CCCCC1
InChIInChI=1S/C14H27N3O2/c15-9-5-2-1-4-8-13(18)16-12-14(19)17-10-6-3-7-11-17/h1-12,15H2,(H,16,18)
InChIKeyXEBOWPPOJUXUGR-UHFFFAOYSA-N
XLogP1.02
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-amino-N-(2-oxo-2-piperidin-1-ylethyl)hexanamide
CID 112687717
4-chloro-N-(2-oxo-2-piperidin-1-ylethyl)butanamide
CID 82109147
N-[2-(azepan-1-yl)-2-oxoethyl]pentanamide
CID 112995931
7-amino-1-pyrrolidin-1-ylheptan-1-one
CID 24707646
4-amino-N-(3-oxo-3-piperidin-1-ylpropyl)butanamide
CID 70095936
7-amino-N-[2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl]heptanamide
CID 119871471
6-(azepan-1-yl)-6-oxohexanamide;hexane-1,6-diamine
CID 174378277
methyl 4-oxo-4-[(2-oxo-2-piperidin-1-ylethyl)amino]butanoate
CID 110712317
2-(2-aminoethylamino)-1-(azepan-1-yl)ethanone
CID 62140336
2-(2-aminoethylamino)-1-piperidin-1-ylethanone
CID 62140335
6-amino-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide
CID 43515188
2-(7-aminoheptanoylamino)acetic acid
CID 18934956

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide?
The IUPAC name of 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide (CID 115597328) is 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide.
What is the SMILES notation for 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide?
The canonical SMILES for 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide is NCCCCCCC(=O)NCC(=O)N1CCCCC1.
What is the InChIKey of 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide?
The InChIKey is XEBOWPPOJUXUGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c15-9-5-2-1-4-8-13(18)16-12-14(19)17-10-6-3-7-11-17/h1-12,15H2,(H,16,18).
What are the key properties of 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide?
7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide has a molecular weight of 269.39 g/mol, XLogP of 1.02, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(2-oxo-2-piperidin-1-ylethyl)heptanamide is sourced from PubChem (CID 115597328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).