CID 11557309

C7H14NO2 — CID 11557309

IUPAC—
SMILESCOC1CCC(C)(C)N1[O]
InChIInChI=1S/C7H14NO2/c1-7(2)5-4-6(10-3)8(7)9/h6H,4-5H2,1-3H3
InChIKeyDDGDPPBKIWKQHM-UHFFFAOYSA-N
MW144.19 g/mol
LogP1.18
Rot. Bonds1

About CID 11557309

CID 11557309 (PubChem CID 11557309) has the molecular formula C7H14NO2 and a molecular weight of 144.19 g/mol.

Molecular Properties

Compound NameCID 11557309
PubChem CID11557309
Molecular FormulaC7H14NO2
Molecular Weight144.19 g/mol
Exact Mass144.10
IUPAC Name—
SMILESCOC1CCC(C)(C)N1[O]
InChIInChI=1S/C7H14NO2/c1-7(2)5-4-6(10-3)8(7)9/h6H,4-5H2,1-3H3
InChIKeyDDGDPPBKIWKQHM-UHFFFAOYSA-N
XLogP1.18
TPSA32.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 11557309?
The IUPAC name of CID 11557309 (CID 11557309) is not available.
What is the SMILES notation for CID 11557309?
The canonical SMILES for CID 11557309 is COC1CCC(C)(C)N1[O].
What is the InChIKey of CID 11557309?
The InChIKey is DDGDPPBKIWKQHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14NO2/c1-7(2)5-4-6(10-3)8(7)9/h6H,4-5H2,1-3H3.
What are the key properties of CID 11557309?
CID 11557309 has a molecular weight of 144.19 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11557309 is sourced from PubChem (CID 11557309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).