CID 58295805

C14H16FN — CID 58295805

IUPAC—
SMILES[CH]C1CC2(CCNCC2)c2cc(F)ccc21
InChIInChI=1S/C14H16FN/c1-10-9-14(4-6-16-7-5-14)13-8-11(15)2-3-12(10)13/h1-3,8,10,16H,4-7,9H2
InChIKeyJRZUVQLIKZIFCO-UHFFFAOYSA-N
MW217.29 g/mol
LogP2.65
Rot. Bonds

About CID 58295805

CID 58295805 (PubChem CID 58295805) has the molecular formula C14H16FN and a molecular weight of 217.29 g/mol.

Molecular Properties

Compound NameCID 58295805
PubChem CID58295805
Molecular FormulaC14H16FN
Molecular Weight217.29 g/mol
Exact Mass217.13
IUPAC Name—
SMILES[CH]C1CC2(CCNCC2)c2cc(F)ccc21
InChIInChI=1S/C14H16FN/c1-10-9-14(4-6-16-7-5-14)13-8-11(15)2-3-12(10)13/h1-3,8,10,16H,4-7,9H2
InChIKeyJRZUVQLIKZIFCO-UHFFFAOYSA-N
XLogP2.65
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.29
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 58295805?
The IUPAC name of CID 58295805 (CID 58295805) is not available.
What is the SMILES notation for CID 58295805?
The canonical SMILES for CID 58295805 is [CH]C1CC2(CCNCC2)c2cc(F)ccc21.
What is the InChIKey of CID 58295805?
The InChIKey is JRZUVQLIKZIFCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN/c1-10-9-14(4-6-16-7-5-14)13-8-11(15)2-3-12(10)13/h1-3,8,10,16H,4-7,9H2.
What are the key properties of CID 58295805?
CID 58295805 has a molecular weight of 217.29 g/mol, XLogP of 2.65, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58295805 is sourced from PubChem (CID 58295805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).