11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione

C15H21N3O3 — CID 64967825

IUPAC11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione
SMILESCc1cc(CN2CCC(=O)NC3(CCCCC3)C2=O)no1
InChIInChI=1S/C15H21N3O3/c1-11-9-12(17-21-11)10-18-8-5-13(19)16-15(14(18)20)6-3-2-4-7-15/h9H,2-8,10H2,1H3,(H,16,19)
InChIKeyCLIXJLVCJYAGAG-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.53
Rot. Bonds2

About 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione

11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione (PubChem CID 64967825) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione.

Molecular Properties

Compound Name11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione
PubChem CID64967825
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione
SMILESCc1cc(CN2CCC(=O)NC3(CCCCC3)C2=O)no1
InChIInChI=1S/C15H21N3O3/c1-11-9-12(17-21-11)10-18-8-5-13(19)16-15(14(18)20)6-3-2-4-7-15/h9H,2-8,10H2,1H3,(H,16,19)
InChIKeyCLIXJLVCJYAGAG-UHFFFAOYSA-N
XLogP1.53
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione with MolForge

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Related Compounds

10-[(3-methyl-1,2-oxazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64968278
10-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 106377160
10-[(5-ethylthiophen-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64882245
11-[(4-methyl-1,3-thiazol-2-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64966399
10-[(5-bromo-2-pyridinyl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 104812836
11-propyl-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64883747
11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64965803
10-(1,3-thiazol-2-ylmethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64965758
11-pent-3-ynyl-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 116645589
10-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 106045858
11-but-3-ynyl-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64972524
10-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 106409683

Frequently Asked Questions

What is the IUPAC name of 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione?
The IUPAC name of 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione (CID 64967825) is 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione.
What is the SMILES notation for 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione?
The canonical SMILES for 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione is Cc1cc(CN2CCC(=O)NC3(CCCCC3)C2=O)no1.
What is the InChIKey of 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione?
The InChIKey is CLIXJLVCJYAGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-11-9-12(17-21-11)10-18-8-5-13(19)16-15(14(18)20)6-3-2-4-7-15/h9H,2-8,10H2,1H3,(H,16,19).
What are the key properties of 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione?
11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione has a molecular weight of 291.35 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione is sourced from PubChem (CID 64967825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).