2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide

C14H21N3O4 — CID 9378986

IUPAC2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide
SMILESCNC(=O)CN(C)C(=O)CN1C(=O)CC2(CCCC2)C1=O
InChIInChI=1S/C14H21N3O4/c1-15-10(18)8-16(2)12(20)9-17-11(19)7-14(13(17)21)5-3-4-6-14/h3-9H2,1-2H3,(H,15,18)
InChIKeyIBKRGMIWUPGGRN-UHFFFAOYSA-N
MW295.34 g/mol
LogP-0.49
Rot. Bonds4

About 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide

2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide (PubChem CID 9378986) has the molecular formula C14H21N3O4 and a molecular weight of 295.34 g/mol. Its IUPAC name is 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide
PubChem CID9378986
Molecular FormulaC14H21N3O4
Molecular Weight295.34 g/mol
Exact Mass295.15
IUPAC Name2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide
SMILESCNC(=O)CN(C)C(=O)CN1C(=O)CC2(CCCC2)C1=O
InChIInChI=1S/C14H21N3O4/c1-15-10(18)8-16(2)12(20)9-17-11(19)7-14(13(17)21)5-3-4-6-14/h3-9H2,1-2H3,(H,15,18)
InChIKeyIBKRGMIWUPGGRN-UHFFFAOYSA-N
XLogP-0.49
TPSA86.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
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-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide (CID 9378986) is 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide is CNC(=O)CN(C)C(=O)CN1C(=O)CC2(CCCC2)C1=O.
What is the InChIKey of 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide?
The InChIKey is IBKRGMIWUPGGRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O4/c1-15-10(18)8-16(2)12(20)9-17-11(19)7-14(13(17)21)5-3-4-6-14/h3-9H2,1-2H3,(H,15,18).
What are the key properties of 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide?
2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide has a molecular weight of 295.34 g/mol, XLogP of -0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide is sourced from PubChem (CID 9378986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).