N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide

C19H21F3N4O4 — CID 134332208

IUPACN-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide
SMILESCOCC(NC(=O)N1CC(=O)NC2=C1N=C(C)CC2)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C19H21F3N4O4/c1-11-3-8-14-17(23-11)26(9-16(27)24-14)18(28)25-15(10-29-2)12-4-6-13(7-5-12)30-19(20,21)22/h4-7,15H,3,8-10H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyYPGNZBRQBJWKRW-UHFFFAOYSA-N
MW426.40 g/mol
LogP2.84
Rot. Bonds5

About N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide

N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide (PubChem CID 134332208) has the molecular formula C19H21F3N4O4 and a molecular weight of 426.40 g/mol. Its IUPAC name is N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide.

Molecular Properties

Compound NameN-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide
PubChem CID134332208
Molecular FormulaC19H21F3N4O4
Molecular Weight426.40 g/mol
Exact Mass426.15
IUPAC NameN-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide
SMILESCOCC(NC(=O)N1CC(=O)NC2=C1N=C(C)CC2)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C19H21F3N4O4/c1-11-3-8-14-17(23-11)26(9-16(27)24-14)18(28)25-15(10-29-2)12-4-6-13(7-5-12)30-19(20,21)22/h4-7,15H,3,8-10H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyYPGNZBRQBJWKRW-UHFFFAOYSA-N
XLogP2.84
TPSA92.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.40
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-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-[1-[4-(2-fluoropropan-2-yloxy)phenyl]-2-(2-methoxyethoxy)ethyl]-7-methyl-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
CID 134332264
6-cyclopropyl-N-[2-ethenoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
CID 162563368
2-methoxy-N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-oxo-1H-pyrimidine-4-carboxamide
CID 137045845
2-[cyclopropyl(methyl)amino]-N-[(1S)-2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-oxo-1H-pyrimidine-4-carboxamide
CID 137045789
N-[2-[(5-bromo-3-pyridinyl)oxy]-1-[4-(2-fluoropropan-2-yloxy)phenyl]ethyl]-7-methyl-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
CID 134332199
2-(3-azabicyclo[3.1.0]hexan-3-yl)-N-[(1S)-2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-oxo-1H-pyrimidine-4-carboxamide
CID 137045761
N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-1,6-naphthyridine-8-carboxamide
CID 121361561
N-[1-[3-fluoro-4-(trifluoromethoxy)phenyl]-2-methoxyethyl]-7-hydroxy-2-oxo-1-(2-trimethylsilylethoxymethyl)-3H-pyrido[2,3-b]pyrazine-4-carboxamide
CID 131742335
2-(3-methoxyazetidin-1-yl)-6-[(4-methoxyphenyl)methoxy]-N-[(1S)-2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]pyrimidine-4-carboxamide
CID 122505582
N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-6-carboxamide
CID 167894520
N-[3-hydroxy-1-[4-(trifluoromethoxy)phenyl]propyl]acetamide
CID 144950554
2-anilino-N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-5-(methylamino)pyrimidine-4-carboxamide
CID 122505595

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide?
The IUPAC name of N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide (CID 134332208) is N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide.
What is the SMILES notation for N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide?
The canonical SMILES for N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide is COCC(NC(=O)N1CC(=O)NC2=C1N=C(C)CC2)c1ccc(OC(F)(F)F)cc1.
What is the InChIKey of N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide?
The InChIKey is YPGNZBRQBJWKRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F3N4O4/c1-11-3-8-14-17(23-11)26(9-16(27)24-14)18(28)25-15(10-29-2)12-4-6-13(7-5-12)30-19(20,21)22/h4-7,15H,3,8-10H2,1-2H3,(H,24,27)(H,25,28).
What are the key properties of N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide?
N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide has a molecular weight of 426.40 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide is sourced from PubChem (CID 134332208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).