N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide

C20H27F3N2O2 — CID 71898762

IUPACN,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESO=C(Cn1cccc(C(F)(F)F)c1=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C20H27F3N2O2/c21-20(22,23)17-12-7-13-24(19(17)27)14-18(26)25(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h7,12-13,15-16H,1-6,8-11,14H2
InChIKeyIEIQYISMVKNOOV-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.36
Rot. Bonds4

About N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide

N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide (PubChem CID 71898762) has the molecular formula C20H27F3N2O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
PubChem CID71898762
Molecular FormulaC20H27F3N2O2
Molecular Weight384.44 g/mol
Exact Mass384.20
IUPAC NameN,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESO=C(Cn1cccc(C(F)(F)F)c1=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C20H27F3N2O2/c21-20(22,23)17-12-7-13-24(19(17)27)14-18(26)25(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h7,12-13,15-16H,1-6,8-11,14H2
InChIKeyIEIQYISMVKNOOV-UHFFFAOYSA-N
XLogP4.36
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The IUPAC name of N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide (CID 71898762) is N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide.
What is the SMILES notation for N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The canonical SMILES for N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide is O=C(Cn1cccc(C(F)(F)F)c1=O)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The InChIKey is IEIQYISMVKNOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27F3N2O2/c21-20(22,23)17-12-7-13-24(19(17)27)14-18(26)25(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h7,12-13,15-16H,1-6,8-11,14H2.
What are the key properties of N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide has a molecular weight of 384.44 g/mol, XLogP of 4.36, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide is sourced from PubChem (CID 71898762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).