N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide

C15H19F3N2O2 — CID 2623868

IUPACN-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESO=C(Cn1cc(C(F)(F)F)ccc1=O)NC1CCCCCC1
InChIInChI=1S/C15H19F3N2O2/c16-15(17,18)11-7-8-14(22)20(9-11)10-13(21)19-12-5-3-1-2-4-6-12/h7-9,12H,1-6,10H2,(H,19,21)
InChIKeyCBZWQPFBQQKSJV-UHFFFAOYSA-N
MW316.32 g/mol
LogP2.71
Rot. Bonds3

About N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide

N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide (PubChem CID 2623868) has the molecular formula C15H19F3N2O2 and a molecular weight of 316.32 g/mol. Its IUPAC name is N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
PubChem CID2623868
Molecular FormulaC15H19F3N2O2
Molecular Weight316.32 g/mol
Exact Mass316.14
IUPAC NameN-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESO=C(Cn1cc(C(F)(F)F)ccc1=O)NC1CCCCCC1
InChIInChI=1S/C15H19F3N2O2/c16-15(17,18)11-7-8-14(22)20(9-11)10-13(21)19-12-5-3-1-2-4-6-12/h7-9,12H,1-6,10H2,(H,19,21)
InChIKeyCBZWQPFBQQKSJV-UHFFFAOYSA-N
XLogP2.71
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.32
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The IUPAC name of N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide (CID 2623868) is N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide.
What is the SMILES notation for N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The canonical SMILES for N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide is O=C(Cn1cc(C(F)(F)F)ccc1=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The InChIKey is CBZWQPFBQQKSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O2/c16-15(17,18)11-7-8-14(22)20(9-11)10-13(21)19-12-5-3-1-2-4-6-12/h7-9,12H,1-6,10H2,(H,19,21).
What are the key properties of N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide has a molecular weight of 316.32 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide is sourced from PubChem (CID 2623868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).