CID 59303766

C7H8N2O — CID 59303766

IUPAC—
SMILES[CH]c1ccc(=O)n(CC)n1
InChIInChI=1S/C7H8N2O/c1-3-9-7(10)5-4-6(2)8-9/h2,4-5H,3H2,1H3
InChIKeyAZSZUOHEYCQNRO-UHFFFAOYSA-N
MW136.15 g/mol
LogP0.32
Rot. Bonds1

About CID 59303766

CID 59303766 (PubChem CID 59303766) has the molecular formula C7H8N2O and a molecular weight of 136.15 g/mol.

Molecular Properties

Compound NameCID 59303766
PubChem CID59303766
Molecular FormulaC7H8N2O
Molecular Weight136.15 g/mol
Exact Mass136.06
IUPAC Name—
SMILES[CH]c1ccc(=O)n(CC)n1
InChIInChI=1S/C7H8N2O/c1-3-9-7(10)5-4-6(2)8-9/h2,4-5H,3H2,1H3
InChIKeyAZSZUOHEYCQNRO-UHFFFAOYSA-N
XLogP0.32
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 59303766?
The IUPAC name of CID 59303766 (CID 59303766) is not available.
What is the SMILES notation for CID 59303766?
The canonical SMILES for CID 59303766 is [CH]c1ccc(=O)n(CC)n1.
What is the InChIKey of CID 59303766?
The InChIKey is AZSZUOHEYCQNRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O/c1-3-9-7(10)5-4-6(2)8-9/h2,4-5H,3H2,1H3.
What are the key properties of CID 59303766?
CID 59303766 has a molecular weight of 136.15 g/mol, XLogP of 0.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59303766 is sourced from PubChem (CID 59303766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).