2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide

C13H24N2O3 — CID 43573998

IUPAC2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide
SMILESCC(NC1CCC2(CC1)OCCO2)C(=O)N(C)C
InChIInChI=1S/C13H24N2O3/c1-10(12(16)15(2)3)14-11-4-6-13(7-5-11)17-8-9-18-13/h10-11,14H,4-9H2,1-3H3
InChIKeyHBZNBJXTFXPVPV-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.74
Rot. Bonds3

About 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide

2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide (PubChem CID 43573998) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide
PubChem CID43573998
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide
SMILESCC(NC1CCC2(CC1)OCCO2)C(=O)N(C)C
InChIInChI=1S/C13H24N2O3/c1-10(12(16)15(2)3)14-11-4-6-13(7-5-11)17-8-9-18-13/h10-11,14H,4-9H2,1-3H3
InChIKeyHBZNBJXTFXPVPV-UHFFFAOYSA-N
XLogP0.74
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide 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-(1,4-dioxaspiro[4.5]decan-8-ylamino)-1-piperidin-1-ylpropan-1-one
CID 60931755
(2R)-N,N-dimethyl-2-[(4-methylcyclohexyl)amino]propanamide
CID 92666114
N,N-dimethyl-2-[(4-propan-2-ylcyclohexyl)amino]propanamide
CID 55106384
N,N-dimethyl-2-(5-oxaspiro[3.5]nonan-8-ylamino)propanamide
CID 79894932
N,N-dimethyl-2-(piperidin-4-ylamino)propanamide
CID 61016597
2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
CID 43573917
N-(1-methylsulfinylpropan-2-yl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 104814286
2-N-(1,4-dioxaspiro[4.5]decan-8-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 61477178
2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,4-dimethylpentanamide
CID 43750672
N-[(1S)-1-cyclohexylethyl]-1,4-dioxaspiro[4.5]decan-8-amine
CID 81387414
N-[(1R)-1-cycloheptylethyl]-1,4-dioxaspiro[4.5]decan-8-amine
CID 81390369
2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N-propan-2-ylacetamide
CID 43567769

Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide?
The IUPAC name of 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide (CID 43573998) is 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide.
What is the SMILES notation for 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide?
The canonical SMILES for 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide is CC(NC1CCC2(CC1)OCCO2)C(=O)N(C)C.
What is the InChIKey of 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide?
The InChIKey is HBZNBJXTFXPVPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-10(12(16)15(2)3)14-11-4-6-13(7-5-11)17-8-9-18-13/h10-11,14H,4-9H2,1-3H3.
What are the key properties of 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide?
2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide has a molecular weight of 256.35 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,N-dimethylpropanamide is sourced from PubChem (CID 43573998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).