2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one

C17H28N2O4 — CID 98897249

IUPAC2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one
SMILESCOCCN1CC2(CCC1=O)CCN(C(=O)[C@@H]1CCOC1)CC2
InChIInChI=1S/C17H28N2O4/c1-22-11-9-19-13-17(4-2-15(19)20)5-7-18(8-6-17)16(21)14-3-10-23-12-14/h14H,2-13H2,1H3/t14-/m1/s1
InChIKeyIWSYFLKMJQNLTH-CQSZACIVSA-N
MW324.42 g/mol
LogP0.90
Rot. Bonds4

About 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one

2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one (PubChem CID 98897249) has the molecular formula C17H28N2O4 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one.

Molecular Properties

Compound Name2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one
PubChem CID98897249
Molecular FormulaC17H28N2O4
Molecular Weight324.42 g/mol
Exact Mass324.20
IUPAC Name2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one
SMILESCOCCN1CC2(CCC1=O)CCN(C(=O)[C@@H]1CCOC1)CC2
InChIInChI=1S/C17H28N2O4/c1-22-11-9-19-13-17(4-2-15(19)20)5-7-18(8-6-17)16(21)14-3-10-23-12-14/h14H,2-13H2,1H3/t14-/m1/s1
InChIKeyIWSYFLKMJQNLTH-CQSZACIVSA-N
XLogP0.90
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-methoxyethyl)-8-(oxane-4-carbonyl)-2,8-diazaspiro[4.5]decan-3-one
CID 98896376
2-(cyclopropylmethyl)-8-(oxolane-3-carbonyl)-2,8-diazaspiro[4.5]decan-3-one
CID 155872829
2-(2-methoxyethyl)-9-(2,4,6-trimethylbenzoyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72876264
2-(2-methoxyethyl)-9-(1-methylimidazole-2-carbonyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 124814570
2-(2-methoxyethyl)-9-(1-phenylcyclopropanecarbonyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72889857
9-(4-chloro-1-methylpyrrole-2-carbonyl)-2-(2-methoxyethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72877994
9-(3-fluoro-4-methylbenzoyl)-2-(2-methoxyethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72906926
(6R)-8-(2-cyclopentylacetyl)-2-(2-methoxyethyl)-2,8-diazaspiro[5.5]undecan-3-one
CID 97153831
9-(2,5-dimethylbenzoyl)-2-(2-methoxyethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72858674
1-(2-methoxyethyl)-7-(oxolane-3-carbonyl)-5,6,8,9-tetrahydropyrido[2,3-d]azepin-2-one
CID 134078748
9-(3-fluoropyridine-4-carbonyl)-2-(2-methoxyethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 98897253
2-(2-methoxyethyl)-9-[3-(4-methylpyrazol-1-yl)propanoyl]-2,9-diazaspiro[5.5]undecan-3-one
CID 72905510

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one?
The IUPAC name of 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one (CID 98897249) is 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one.
What is the SMILES notation for 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one?
The canonical SMILES for 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one is COCCN1CC2(CCC1=O)CCN(C(=O)[C@@H]1CCOC1)CC2.
What is the InChIKey of 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one?
The InChIKey is IWSYFLKMJQNLTH-CQSZACIVSA-N. The full InChI is InChI=1S/C17H28N2O4/c1-22-11-9-19-13-17(4-2-15(19)20)5-7-18(8-6-17)16(21)14-3-10-23-12-14/h14H,2-13H2,1H3/t14-/m1/s1.
What are the key properties of 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one?
2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one has a molecular weight of 324.42 g/mol, XLogP of 0.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-9-[(3R)-oxolane-3-carbonyl]-2,9-diazaspiro[5.5]undecan-3-one is sourced from PubChem (CID 98897249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).