CID 58998141

C11H20N2O — CID 58998141

IUPAC
SMILES[CH]C1(N2CCOCC2)CCN(C)CC1
InChIInChI=1S/C11H20N2O/c1-11(3-5-12(2)6-4-11)13-7-9-14-10-8-13/h1H,3-10H2,2H3
InChIKeyRXIFIYFSYXZJMB-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.49
Rot. Bonds1

About CID 58998141

CID 58998141 (PubChem CID 58998141) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol.

Molecular Properties

Compound NameCID 58998141
PubChem CID58998141
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name
SMILES[CH]C1(N2CCOCC2)CCN(C)CC1
InChIInChI=1S/C11H20N2O/c1-11(3-5-12(2)6-4-11)13-7-9-14-10-8-13/h1H,3-10H2,2H3
InChIKeyRXIFIYFSYXZJMB-UHFFFAOYSA-N
XLogP0.49
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 58998141?
The IUPAC name of CID 58998141 (CID 58998141) is not available.
What is the SMILES notation for CID 58998141?
The canonical SMILES for CID 58998141 is [CH]C1(N2CCOCC2)CCN(C)CC1.
What is the InChIKey of CID 58998141?
The InChIKey is RXIFIYFSYXZJMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-11(3-5-12(2)6-4-11)13-7-9-14-10-8-13/h1H,3-10H2,2H3.
What are the key properties of CID 58998141?
CID 58998141 has a molecular weight of 196.29 g/mol, XLogP of 0.49, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58998141 is sourced from PubChem (CID 58998141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).