CID 59041163

C12H24NO2 — CID 59041163

IUPAC—
SMILESCCC1(C)CC(O)C(C)C(C)(CC)N1[O]
InChIInChI=1S/C12H24NO2/c1-6-11(4)8-10(14)9(3)12(5,7-2)13(11)15/h9-10,14H,6-8H2,1-5H3
InChIKeyZBRYWCIFVQEXCP-UHFFFAOYSA-N
MW214.33 g/mol
LogP2.37
Rot. Bonds2

About CID 59041163

CID 59041163 (PubChem CID 59041163) has the molecular formula C12H24NO2 and a molecular weight of 214.33 g/mol.

Molecular Properties

Compound NameCID 59041163
PubChem CID59041163
Molecular FormulaC12H24NO2
Molecular Weight214.33 g/mol
Exact Mass214.18
IUPAC Name—
SMILESCCC1(C)CC(O)C(C)C(C)(CC)N1[O]
InChIInChI=1S/C12H24NO2/c1-6-11(4)8-10(14)9(3)12(5,7-2)13(11)15/h9-10,14H,6-8H2,1-5H3
InChIKeyZBRYWCIFVQEXCP-UHFFFAOYSA-N
XLogP2.37
TPSA43.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59041163?
The IUPAC name of CID 59041163 (CID 59041163) is not available.
What is the SMILES notation for CID 59041163?
The canonical SMILES for CID 59041163 is CCC1(C)CC(O)C(C)C(C)(CC)N1[O].
What is the InChIKey of CID 59041163?
The InChIKey is ZBRYWCIFVQEXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24NO2/c1-6-11(4)8-10(14)9(3)12(5,7-2)13(11)15/h9-10,14H,6-8H2,1-5H3.
What are the key properties of CID 59041163?
CID 59041163 has a molecular weight of 214.33 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59041163 is sourced from PubChem (CID 59041163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).