8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione

C14H24N2O3 — CID 104594510

IUPAC8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione
SMILESCC(O)CNCCN1C(=O)CC2(CCCC2)CC1=O
InChIInChI=1S/C14H24N2O3/c1-11(17)10-15-6-7-16-12(18)8-14(9-13(16)19)4-2-3-5-14/h11,15,17H,2-10H2,1H3
InChIKeySOLQUTMBPVXYCV-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.67
Rot. Bonds5

About 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione

8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione (PubChem CID 104594510) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione.

Molecular Properties

Compound Name8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione
PubChem CID104594510
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione
SMILESCC(O)CNCCN1C(=O)CC2(CCCC2)CC1=O
InChIInChI=1S/C14H24N2O3/c1-11(17)10-15-6-7-16-12(18)8-14(9-13(16)19)4-2-3-5-14/h11,15,17H,2-10H2,1H3
InChIKeySOLQUTMBPVXYCV-UHFFFAOYSA-N
XLogP0.67
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione
CID 104594518
3-(3-hydroxy-2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione
CID 65036014
3-(2-aminopropyl)-3-azaspiro[5.5]undecane-2,4-dione
CID 55228574
3-ethyl-3-azaspiro[5.5]undecane-2,4-dione
CID 19814204
2-(7,9-dioxo-8-azaspiro[4.5]decan-8-yl)-N-methylacetamide
CID 4500586
8-(4-aminobutyl)-8-azaspiro[4.5]decane-7,9-dione
CID 11746691
8-[2-[bis(2-hydroxyethyl)amino]ethyl]-8-azaspiro[4.5]decane-7,9-dione
CID 165344828
8-(4-methylsulfanylbutyl)-8-azaspiro[4.5]decane-7,9-dione
CID 139959182
3-[2-(diethylamino)ethyl]-3-azaspiro[5.5]undecane-2,4-dione
CID 125489551
1-[2-(azepan-1-yl)ethylamino]propan-2-ol
CID 104594544
2-(2,4-dioxo-3-azaspiro[5.5]undecan-3-yl)acetic acid
CID 43804746
3-(4-aminobutyl)-3-azaspiro[5.5]undecane-2,4-dione
CID 62642476

Frequently Asked Questions

What is the IUPAC name of 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione?
The IUPAC name of 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione (CID 104594510) is 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione.
What is the SMILES notation for 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione?
The canonical SMILES for 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione is CC(O)CNCCN1C(=O)CC2(CCCC2)CC1=O.
What is the InChIKey of 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione?
The InChIKey is SOLQUTMBPVXYCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-11(17)10-15-6-7-16-12(18)8-14(9-13(16)19)4-2-3-5-14/h11,15,17H,2-10H2,1H3.
What are the key properties of 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione?
8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione has a molecular weight of 268.36 g/mol, XLogP of 0.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione is sourced from PubChem (CID 104594510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).