CID 101128218

C14H24NO5 — CID 101128218

IUPAC
SMILESCC1(C)CC(OC(=O)CCCC(=O)O)CC(C)(C)N1[O]
InChIInChI=1S/C14H24NO5/c1-13(2)8-10(9-14(3,4)15(13)19)20-12(18)7-5-6-11(16)17/h10H,5-9H2,1-4H3,(H,16,17)
InChIKeyORVZFKRWMYBSLV-UHFFFAOYSA-N
MW286.35 g/mol
LogP2.15
Rot. Bonds5

About CID 101128218

CID 101128218 (PubChem CID 101128218) has the molecular formula C14H24NO5 and a molecular weight of 286.35 g/mol.

Molecular Properties

Compound NameCID 101128218
PubChem CID101128218
Molecular FormulaC14H24NO5
Molecular Weight286.35 g/mol
Exact Mass286.17
IUPAC Name
SMILESCC1(C)CC(OC(=O)CCCC(=O)O)CC(C)(C)N1[O]
InChIInChI=1S/C14H24NO5/c1-13(2)8-10(9-14(3,4)15(13)19)20-12(18)7-5-6-11(16)17/h10H,5-9H2,1-4H3,(H,16,17)
InChIKeyORVZFKRWMYBSLV-UHFFFAOYSA-N
XLogP2.15
TPSA86.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 101128218?
The IUPAC name of CID 101128218 (CID 101128218) is not available.
What is the SMILES notation for CID 101128218?
The canonical SMILES for CID 101128218 is CC1(C)CC(OC(=O)CCCC(=O)O)CC(C)(C)N1[O].
What is the InChIKey of CID 101128218?
The InChIKey is ORVZFKRWMYBSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24NO5/c1-13(2)8-10(9-14(3,4)15(13)19)20-12(18)7-5-6-11(16)17/h10H,5-9H2,1-4H3,(H,16,17).
What are the key properties of CID 101128218?
CID 101128218 has a molecular weight of 286.35 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101128218 is sourced from PubChem (CID 101128218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).