N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide

C18H16F3N5O2 — CID 155219534

IUPACN-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide
SMILESN#Cc1ncc(OC2CCC(NC(=O)c3cnccn3)CC2)cc1C(F)(F)F
InChIInChI=1S/C18H16F3N5O2/c19-18(20,21)14-7-13(9-25-15(14)8-22)28-12-3-1-11(2-4-12)26-17(27)16-10-23-5-6-24-16/h5-7,9-12H,1-4H2,(H,26,27)
InChIKeyROZWOHYMNHJPOW-UHFFFAOYSA-N
MW391.35 g/mol
LogP2.88
Rot. Bonds4

About N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide

N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide (PubChem CID 155219534) has the molecular formula C18H16F3N5O2 and a molecular weight of 391.35 g/mol. Its IUPAC name is N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide
PubChem CID155219534
Molecular FormulaC18H16F3N5O2
Molecular Weight391.35 g/mol
Exact Mass391.13
IUPAC NameN-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide
SMILESN#Cc1ncc(OC2CCC(NC(=O)c3cnccn3)CC2)cc1C(F)(F)F
InChIInChI=1S/C18H16F3N5O2/c19-18(20,21)14-7-13(9-25-15(14)8-22)28-12-3-1-11(2-4-12)26-17(27)16-10-23-5-6-24-16/h5-7,9-12H,1-4H2,(H,26,27)
InChIKeyROZWOHYMNHJPOW-UHFFFAOYSA-N
XLogP2.88
TPSA100.79 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.35
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[(5-bromo-6-cyano-3-pyridinyl)oxy]cyclohexyl]pyrazine-2-carboxamide
CID 155219537
N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]-1-methyltriazole-4-carboxamide
CID 155218567
N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]-2-methyltetrazole-5-carboxamide
CID 155218576
N-[4-(3-chloro-4-cyanophenoxy)cyclohexyl]pyrazine-2-carboxamide
CID 155218483
N-[2-[4-cyano-3-(trifluoromethyl)phenoxy]spiro[3.3]heptan-6-yl]pyrazine-2-carboxamide
CID 155218477
N-[4-[(5-bromo-6-cyano-3-pyridinyl)oxy]cyclohexyl]pyrimidine-5-carboxamide
CID 155219529
N-[4-(2-methylbutan-2-yl)cyclohexyl]pyrazine-2-carboxamide
CID 18155873
3-(pyrazine-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 66032324
N-[4-[4-cyano-3-(trifluoromethyl)phenoxy]cyclohexyl]-5-methyl-1,3,4-oxadiazole-2-carboxamide
CID 166981032
N-[4-[4-cyano-3-(trifluoromethyl)phenoxy]cyclohexyl]-2-(4-formylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 169195178
N-(4,4-dimethylcyclohexyl)pyrazine-2-carboxamide
CID 130233496
N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-4-fluorobenzamide
CID 91626145

Frequently Asked Questions

What is the IUPAC name of N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide?
The IUPAC name of N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide (CID 155219534) is N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide is N#Cc1ncc(OC2CCC(NC(=O)c3cnccn3)CC2)cc1C(F)(F)F.
What is the InChIKey of N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide?
The InChIKey is ROZWOHYMNHJPOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F3N5O2/c19-18(20,21)14-7-13(9-25-15(14)8-22)28-12-3-1-11(2-4-12)26-17(27)16-10-23-5-6-24-16/h5-7,9-12H,1-4H2,(H,26,27).
What are the key properties of N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide?
N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide has a molecular weight of 391.35 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[6-cyano-5-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazine-2-carboxamide is sourced from PubChem (CID 155219534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).