9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione

C16H26N2O3 — CID 103142038

IUPAC9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
SMILESCC1CCC(CN2C(=O)C3(CCCC3)NC(=O)CC2C)O1
InChIInChI=1S/C16H26N2O3/c1-11-9-14(19)17-16(7-3-4-8-16)15(20)18(11)10-13-6-5-12(2)21-13/h11-13H,3-10H2,1-2H3,(H,17,19)
InChIKeyKYDPJICSLXYQTI-UHFFFAOYSA-N
MW294.39 g/mol
LogP1.60
Rot. Bonds2

About 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione

9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione (PubChem CID 103142038) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione.

Molecular Properties

Compound Name9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
PubChem CID103142038
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
SMILESCC1CCC(CN2C(=O)C3(CCCC3)NC(=O)CC2C)O1
InChIInChI=1S/C16H26N2O3/c1-11-9-14(19)17-16(7-3-4-8-16)15(20)18(11)10-13-6-5-12(2)21-13/h11-13H,3-10H2,1-2H3,(H,17,19)
InChIKeyKYDPJICSLXYQTI-UHFFFAOYSA-N
XLogP1.60
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione?
The IUPAC name of 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione (CID 103142038) is 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione.
What is the SMILES notation for 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione?
The canonical SMILES for 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione is CC1CCC(CN2C(=O)C3(CCCC3)NC(=O)CC2C)O1.
What is the InChIKey of 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione?
The InChIKey is KYDPJICSLXYQTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-11-9-14(19)17-16(7-3-4-8-16)15(20)18(11)10-13-6-5-12(2)21-13/h11-13H,3-10H2,1-2H3,(H,17,19).
What are the key properties of 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione?
9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione has a molecular weight of 294.39 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-10-[(5-methyloxolan-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione is sourced from PubChem (CID 103142038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).