N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide

C13H21N3O4 — CID 154749930

IUPACN-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
SMILESCN1CC(NC(=O)N2CCC3(CC2)OCCO3)CC1=O
InChIInChI=1S/C13H21N3O4/c1-15-9-10(8-11(15)17)14-12(18)16-4-2-13(3-5-16)19-6-7-20-13/h10H,2-9H2,1H3,(H,14,18)
InChIKeyZIIHFNFHSMNYDQ-UHFFFAOYSA-N
MW283.33 g/mol
LogP-0.23
Rot. Bonds1

About N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide

N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide (PubChem CID 154749930) has the molecular formula C13H21N3O4 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
PubChem CID154749930
Molecular FormulaC13H21N3O4
Molecular Weight283.33 g/mol
Exact Mass283.15
IUPAC NameN-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
SMILESCN1CC(NC(=O)N2CCC3(CC2)OCCO3)CC1=O
InChIInChI=1S/C13H21N3O4/c1-15-9-10(8-11(15)17)14-12(18)16-4-2-13(3-5-16)19-6-7-20-13/h10H,2-9H2,1H3,(H,14,18)
InChIKeyZIIHFNFHSMNYDQ-UHFFFAOYSA-N
XLogP-0.23
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide 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

N-propan-2-yl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
CID 47236079
N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]cyclopent-3-ene-1-carboxamide
CID 129370733
N-(4-acetamidophenyl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
CID 108989746
2-ethyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
CID 60616692
1-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-3-propan-2-ylurea
CID 95969340
1-(1-methyl-5-oxopyrrolidin-3-yl)-3-propan-2-ylurea
CID 71789164
tert-butyl N-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]carbamate
CID 45092180
N-(3-methylbutyl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
CID 110299714
4-[(1-methyl-5-oxopyrrolidin-3-yl)carbamoyl]benzoic acid
CID 119184714
N-(1-methyl-5-oxopyrrolidin-3-yl)-5-oxopyrrolidine-2-carboxamide
CID 110745995
1-(aminomethyl)-N-(1-methyl-5-oxopyrrolidin-3-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119758192
1-[(3-methyloxetan-3-yl)methyl]-3-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]urea
CID 138049629

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The IUPAC name of N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide (CID 154749930) is N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide is CN1CC(NC(=O)N2CCC3(CC2)OCCO3)CC1=O.
What is the InChIKey of N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The InChIKey is ZIIHFNFHSMNYDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O4/c1-15-9-10(8-11(15)17)14-12(18)16-4-2-13(3-5-16)19-6-7-20-13/h10H,2-9H2,1H3,(H,14,18).
What are the key properties of N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide has a molecular weight of 283.33 g/mol, XLogP of -0.23, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-5-oxopyrrolidin-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 154749930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).