N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide

C19H25N3O3 — CID 2372376

IUPACN-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide
SMILESCC(C)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C19H25N3O3/c1-14(2)21(12-15-8-4-3-5-9-15)16(23)13-22-17(24)19(20-18(22)25)10-6-7-11-19/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H,20,25)
InChIKeyDWAXSYITLZTZLZ-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.29
Rot. Bonds5

About N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide

N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide (PubChem CID 2372376) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide
PubChem CID2372376
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide
SMILESCC(C)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C19H25N3O3/c1-14(2)21(12-15-8-4-3-5-9-15)16(23)13-22-17(24)19(20-18(22)25)10-6-7-11-19/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H,20,25)
InChIKeyDWAXSYITLZTZLZ-UHFFFAOYSA-N
XLogP2.29
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide?
The IUPAC name of N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide (CID 2372376) is N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide?
The canonical SMILES for N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide is CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCCC2)C1=O.
What is the InChIKey of N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide?
The InChIKey is DWAXSYITLZTZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-14(2)21(12-15-8-4-3-5-9-15)16(23)13-22-17(24)19(20-18(22)25)10-6-7-11-19/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H,20,25).
What are the key properties of N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide?
N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide has a molecular weight of 343.43 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 2372376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).