CID 102086094

C15H24NO4 — CID 102086094

IUPAC—
SMILES[O]N1C2(CCC(O)CC2)CC(=O)CC12CCC(O)CC2
InChIInChI=1S/C15H24NO4/c17-11-1-5-14(6-2-11)9-13(19)10-15(16(14)20)7-3-12(18)4-8-15/h11-12,17-18H,1-10H2
InChIKeyVUAYMYFLCFJFKB-UHFFFAOYSA-N
MW282.36 g/mol
LogP1.34
Rot. Bonds

About CID 102086094

CID 102086094 (PubChem CID 102086094) has the molecular formula C15H24NO4 and a molecular weight of 282.36 g/mol.

Molecular Properties

Compound NameCID 102086094
PubChem CID102086094
Molecular FormulaC15H24NO4
Molecular Weight282.36 g/mol
Exact Mass282.17
IUPAC Name—
SMILES[O]N1C2(CCC(O)CC2)CC(=O)CC12CCC(O)CC2
InChIInChI=1S/C15H24NO4/c17-11-1-5-14(6-2-11)9-13(19)10-15(16(14)20)7-3-12(18)4-8-15/h11-12,17-18H,1-10H2
InChIKeyVUAYMYFLCFJFKB-UHFFFAOYSA-N
XLogP1.34
TPSA80.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

CID 102086095
CID 102086095
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8-hydroxyspiro[4.5]decane-1,4-dione
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7-hydroxy-1-methylspiro[3.5]nonan-3-one
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CID 166682646
2-(7-hydroxy-3-oxo-2-azaspiro[3.5]nonan-2-yl)acetamide
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8-hydroxy-6-azaspiro[3.5]nonan-2-one;hydrochloride
CID 170901669
CID 159016368
CID 159016368
6-hydroxycyclododecan-1-one
CID 130125140
7-hydroxycyclododecan-1-one
CID 130125137
4-(4-hydroxycyclohexyl)cyclohexan-1-one
CID 10198069

Frequently Asked Questions

What is the IUPAC name of CID 102086094?
The IUPAC name of CID 102086094 (CID 102086094) is not available.
What is the SMILES notation for CID 102086094?
The canonical SMILES for CID 102086094 is [O]N1C2(CCC(O)CC2)CC(=O)CC12CCC(O)CC2.
What is the InChIKey of CID 102086094?
The InChIKey is VUAYMYFLCFJFKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24NO4/c17-11-1-5-14(6-2-11)9-13(19)10-15(16(14)20)7-3-12(18)4-8-15/h11-12,17-18H,1-10H2.
What are the key properties of CID 102086094?
CID 102086094 has a molecular weight of 282.36 g/mol, XLogP of 1.34, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102086094 is sourced from PubChem (CID 102086094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).