CID 140622478

C16H24FN2 — CID 140622478

IUPAC—
SMILESC[C](C)c1cc(F)cc(CNC2CCN(C)CC2)c1
InChIInChI=1S/C16H24FN2/c1-12(2)14-8-13(9-15(17)10-14)11-18-16-4-6-19(3)7-5-16/h8-10,16,18H,4-7,11H2,1-3H3
InChIKeyFQDDEPPJNACKSW-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.97
Rot. Bonds4

About CID 140622478

CID 140622478 (PubChem CID 140622478) has the molecular formula C16H24FN2 and a molecular weight of 263.38 g/mol.

Molecular Properties

Compound NameCID 140622478
PubChem CID140622478
Molecular FormulaC16H24FN2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name—
SMILESC[C](C)c1cc(F)cc(CNC2CCN(C)CC2)c1
InChIInChI=1S/C16H24FN2/c1-12(2)14-8-13(9-15(17)10-14)11-18-16-4-6-19(3)7-5-16/h8-10,16,18H,4-7,11H2,1-3H3
InChIKeyFQDDEPPJNACKSW-UHFFFAOYSA-N
XLogP2.97
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 140622478?
The IUPAC name of CID 140622478 (CID 140622478) is not available.
What is the SMILES notation for CID 140622478?
The canonical SMILES for CID 140622478 is C[C](C)c1cc(F)cc(CNC2CCN(C)CC2)c1.
What is the InChIKey of CID 140622478?
The InChIKey is FQDDEPPJNACKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN2/c1-12(2)14-8-13(9-15(17)10-14)11-18-16-4-6-19(3)7-5-16/h8-10,16,18H,4-7,11H2,1-3H3.
What are the key properties of CID 140622478?
CID 140622478 has a molecular weight of 263.38 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 140622478 is sourced from PubChem (CID 140622478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).