CID 10929857

C15H21O4 — CID 10929857

IUPAC—
SMILES[CH2][C]([CH][C@H]1CC[C@H](C(C)=O)C[C@@H]1C(C)=O)C(=O)OC
InChIInChI=1S/C15H21O4/c1-9(15(18)19-4)7-13-6-5-12(10(2)16)8-14(13)11(3)17/h7,12-14H,1,5-6,8H2,2-4H3/t12-,13+,14+/m0/s1
InChIKeyCJHKRPRZSFYFGP-BFHYXJOUSA-N
MW265.33 g/mol
LogP1.98
Rot. Bonds5

About CID 10929857

CID 10929857 (PubChem CID 10929857) has the molecular formula C15H21O4 and a molecular weight of 265.33 g/mol.

Molecular Properties

Compound NameCID 10929857
PubChem CID10929857
Molecular FormulaC15H21O4
Molecular Weight265.33 g/mol
Exact Mass265.14
IUPAC Name—
SMILES[CH2][C]([CH][C@H]1CC[C@H](C(C)=O)C[C@@H]1C(C)=O)C(=O)OC
InChIInChI=1S/C15H21O4/c1-9(15(18)19-4)7-13-6-5-12(10(2)16)8-14(13)11(3)17/h7,12-14H,1,5-6,8H2,2-4H3/t12-,13+,14+/m0/s1
InChIKeyCJHKRPRZSFYFGP-BFHYXJOUSA-N
XLogP1.98
TPSA60.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Cyclohexanepropanoic acid, 2-oxo-, methyl ester
CID 112036
Methyl 6-[3-(methoxycarbonyl)-4,4-dimethyl-2,6-dioxocyclohexyl]-6-oxohexanoate
CID 3743979
Diethyl 2-oxo-1,3-cyclohexanedipropionate
CID 317753
2-[(1S,3S,4R)-4-methyl-2-oxo-3-(3-oxobutyl)cyclohexyl]propan-2-yl formate
CID 21628174
Methyl 4-tert-butyl-2-methylcyclohexanecarboxylate
CID 4644897
rac-methyl (1R,2R,4R)-5-oxobicyclo[2.2.2]octane-2-carboxylate
CID 12273593
Methyl 4-acetylcyclohexanecarboxylate
CID 22421109
Methyl 2,2-dimethyl-4-oxocyclohexane-1-carboxylate
CID 58456348
Methyl 2,6-dimethyl-4-oxocyclohexane-1-carboxylate
CID 70550036
[(2R)-2-[(1S,3S,4R)-4-methyl-2-oxo-3-(3-oxobutyl)cyclohexyl]propyl] formate
CID 10563840
Dihydroartemisinin impurity F
CID 21575634
(2R)-2-[(1R,2R,3S,4R)-2-formyl-4-methyl-3-(3-oxobutyl)cyclohexyl]propanoic acid
CID 21631198

Frequently Asked Questions

What is the IUPAC name of CID 10929857?
The IUPAC name of CID 10929857 (CID 10929857) is not available.
What is the SMILES notation for CID 10929857?
The canonical SMILES for CID 10929857 is [CH2][C]([CH][C@H]1CC[C@H](C(C)=O)C[C@@H]1C(C)=O)C(=O)OC.
What is the InChIKey of CID 10929857?
The InChIKey is CJHKRPRZSFYFGP-BFHYXJOUSA-N. The full InChI is InChI=1S/C15H21O4/c1-9(15(18)19-4)7-13-6-5-12(10(2)16)8-14(13)11(3)17/h7,12-14H,1,5-6,8H2,2-4H3/t12-,13+,14+/m0/s1.
What are the key properties of CID 10929857?
CID 10929857 has a molecular weight of 265.33 g/mol, XLogP of 1.98, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10929857 is sourced from PubChem (CID 10929857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).