CID 11708102

C8H16NO2 — CID 11708102

IUPAC—
SMILESCCOC1CCC(C)(C)N1[O]
InChIInChI=1S/C8H16NO2/c1-4-11-7-5-6-8(2,3)9(7)10/h7H,4-6H2,1-3H3
InChIKeyJPLSVQGCJHINQB-UHFFFAOYSA-N
MW158.22 g/mol
LogP1.57
Rot. Bonds2

About CID 11708102

CID 11708102 (PubChem CID 11708102) has the molecular formula C8H16NO2 and a molecular weight of 158.22 g/mol.

Molecular Properties

Compound NameCID 11708102
PubChem CID11708102
Molecular FormulaC8H16NO2
Molecular Weight158.22 g/mol
Exact Mass158.12
IUPAC Name—
SMILESCCOC1CCC(C)(C)N1[O]
InChIInChI=1S/C8H16NO2/c1-4-11-7-5-6-8(2,3)9(7)10/h7H,4-6H2,1-3H3
InChIKeyJPLSVQGCJHINQB-UHFFFAOYSA-N
XLogP1.57
TPSA32.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.22
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 11708102?
The IUPAC name of CID 11708102 (CID 11708102) is not available.
What is the SMILES notation for CID 11708102?
The canonical SMILES for CID 11708102 is CCOC1CCC(C)(C)N1[O].
What is the InChIKey of CID 11708102?
The InChIKey is JPLSVQGCJHINQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16NO2/c1-4-11-7-5-6-8(2,3)9(7)10/h7H,4-6H2,1-3H3.
What are the key properties of CID 11708102?
CID 11708102 has a molecular weight of 158.22 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11708102 is sourced from PubChem (CID 11708102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).