CID 59909654

C14H16N2O — CID 59909654

IUPAC—
SMILES[CH]N1CCC2(CC1)C(=O)N(C)c1ccccc12
InChIInChI=1S/C14H16N2O/c1-15-9-7-14(8-10-15)11-5-3-4-6-12(11)16(2)13(14)17/h1,3-6H,7-10H2,2H3
InChIKeyGFGSSTKLDFPJGN-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.67
Rot. Bonds

About CID 59909654

CID 59909654 (PubChem CID 59909654) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol.

Molecular Properties

Compound NameCID 59909654
PubChem CID59909654
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name—
SMILES[CH]N1CCC2(CC1)C(=O)N(C)c1ccccc12
InChIInChI=1S/C14H16N2O/c1-15-9-7-14(8-10-15)11-5-3-4-6-12(11)16(2)13(14)17/h1,3-6H,7-10H2,2H3
InChIKeyGFGSSTKLDFPJGN-UHFFFAOYSA-N
XLogP1.67
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59909654?
The IUPAC name of CID 59909654 (CID 59909654) is not available.
What is the SMILES notation for CID 59909654?
The canonical SMILES for CID 59909654 is [CH]N1CCC2(CC1)C(=O)N(C)c1ccccc12.
What is the InChIKey of CID 59909654?
The InChIKey is GFGSSTKLDFPJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-15-9-7-14(8-10-15)11-5-3-4-6-12(11)16(2)13(14)17/h1,3-6H,7-10H2,2H3.
What are the key properties of CID 59909654?
CID 59909654 has a molecular weight of 228.30 g/mol, XLogP of 1.67, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59909654 is sourced from PubChem (CID 59909654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).