2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide

C15H23N3O4 — CID 9378993

IUPAC2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide
SMILESCCCNC(=O)CNC(=O)CN1C(=O)CC2(CCCC2)C1=O
InChIInChI=1S/C15H23N3O4/c1-2-7-16-11(19)9-17-12(20)10-18-13(21)8-15(14(18)22)5-3-4-6-15/h2-10H2,1H3,(H,16,19)(H,17,20)
InChIKeyPOEKOHHZIWUHNU-UHFFFAOYSA-N
MW309.37 g/mol
LogP-0.05
Rot. Bonds6

About 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide

2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide (PubChem CID 9378993) has the molecular formula C15H23N3O4 and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide
PubChem CID9378993
Molecular FormulaC15H23N3O4
Molecular Weight309.37 g/mol
Exact Mass309.17
IUPAC Name2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide
SMILESCCCNC(=O)CNC(=O)CN1C(=O)CC2(CCCC2)C1=O
InChIInChI=1S/C15H23N3O4/c1-2-7-16-11(19)9-17-12(20)10-18-13(21)8-15(14(18)22)5-3-4-6-15/h2-10H2,1H3,(H,16,19)(H,17,20)
InChIKeyPOEKOHHZIWUHNU-UHFFFAOYSA-N
XLogP-0.05
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-(2-oxo-4,4-dipropylpyrrolidin-1-yl)butanamide
CID 11207545
tert-butyl N-[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)ethyl]carbamate
CID 2795738
3-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide
CID 91925461
2-Isopropyl-3-oxo-N~1~-[3-(1-pyrrolidinyl)propyl]-2-azaspiro[3.4]octane-1-carboxamide
CID 124053889
N-(2-oxo-2-pyrrolidin-1-ylethyl)cyclopentanecarboxamide
CID 40140501
2-cyclopentyl-N-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]acetamide
CID 72014686
N-(cyclopropylmethyl)-2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetamide
CID 75402678
2-[3-methyl-3-(2-methylpropyl)-2,5-dioxopyrrolidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 72003342
2-[(3R)-3-methyl-3-(2-methylpropyl)-2,5-dioxopyrrolidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 97568956
2-[(3S)-3-methyl-3-(2-methylpropyl)-2,5-dioxopyrrolidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 97568957
N-({1-[2-(3-oxo-2-azaspiro[4.4]non-2-yl)acetyl]-3-piperidinyl}methyl)acetamide
CID 45209497
2-[1-[2-(Methylamino)-2-oxoethyl]-3-(2-methylpropyl)-2-oxopyrrolidin-3-yl]acetamide
CID 19705569

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide?
The IUPAC name of 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide (CID 9378993) is 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide.
What is the SMILES notation for 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide?
The canonical SMILES for 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide is CCCNC(=O)CNC(=O)CN1C(=O)CC2(CCCC2)C1=O.
What is the InChIKey of 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide?
The InChIKey is POEKOHHZIWUHNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4/c1-2-7-16-11(19)9-17-12(20)10-18-13(21)8-15(14(18)22)5-3-4-6-15/h2-10H2,1H3,(H,16,19)(H,17,20).
What are the key properties of 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide?
2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide has a molecular weight of 309.37 g/mol, XLogP of -0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)acetyl]amino]-N-propylacetamide is sourced from PubChem (CID 9378993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).