CID 164666940

C14H13N2O — CID 164666940

IUPAC
SMILESC[N]c1ccccc1C(=O)Nc1ccccc1
InChIInChI=1S/C14H13N2O/c1-15-13-10-6-5-9-12(13)14(17)16-11-7-3-2-4-8-11/h2-10H,1H3,(H,16,17)
InChIKeyDKISALJJYLUJPH-UHFFFAOYSA-N
MW225.27 g/mol
LogP2.80
Rot. Bonds3

About CID 164666940

CID 164666940 (PubChem CID 164666940) has the molecular formula C14H13N2O and a molecular weight of 225.27 g/mol.

Molecular Properties

Compound NameCID 164666940
PubChem CID164666940
Molecular FormulaC14H13N2O
Molecular Weight225.27 g/mol
Exact Mass225.10
IUPAC Name
SMILESC[N]c1ccccc1C(=O)Nc1ccccc1
InChIInChI=1S/C14H13N2O/c1-15-13-10-6-5-9-12(13)14(17)16-11-7-3-2-4-8-11/h2-10H,1H3,(H,16,17)
InChIKeyDKISALJJYLUJPH-UHFFFAOYSA-N
XLogP2.80
TPSA43.20 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 164666940?
The IUPAC name of CID 164666940 (CID 164666940) is not available.
What is the SMILES notation for CID 164666940?
The canonical SMILES for CID 164666940 is C[N]c1ccccc1C(=O)Nc1ccccc1.
What is the InChIKey of CID 164666940?
The InChIKey is DKISALJJYLUJPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N2O/c1-15-13-10-6-5-9-12(13)14(17)16-11-7-3-2-4-8-11/h2-10H,1H3,(H,16,17).
What are the key properties of CID 164666940?
CID 164666940 has a molecular weight of 225.27 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 164666940 is sourced from PubChem (CID 164666940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).