N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide

C16H19N3O3 — CID 124854277

IUPACN-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide
SMILESCCOc1ccc([C@H](COC)NC(=O)c2cnccn2)cc1
InChIInChI=1S/C16H19N3O3/c1-3-22-13-6-4-12(5-7-13)15(11-21-2)19-16(20)14-10-17-8-9-18-14/h4-10,15H,3,11H2,1-2H3,(H,19,20)/t15-/m0/s1
InChIKeyWXLWUCLXXAZAPC-HNNXBMFYSA-N
MW301.35 g/mol
LogP1.99
Rot. Bonds7

About N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide

N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide (PubChem CID 124854277) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide
PubChem CID124854277
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide
SMILESCCOc1ccc([C@H](COC)NC(=O)c2cnccn2)cc1
InChIInChI=1S/C16H19N3O3/c1-3-22-13-6-4-12(5-7-13)15(11-21-2)19-16(20)14-10-17-8-9-18-14/h4-10,15H,3,11H2,1-2H3,(H,19,20)/t15-/m0/s1
InChIKeyWXLWUCLXXAZAPC-HNNXBMFYSA-N
XLogP1.99
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]-2-methylpyrazole-3-carboxamide
CID 100646270
N-[1-(4-ethoxyphenyl)-2-methoxyethyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 119052898
N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]-6-methylpyridine-3-carboxamide
CID 124730066
methyl (3R)-3-(4-chlorophenyl)-3-(pyrazine-2-carbonylamino)propanoate
CID 27700837
N-(2,5-diethoxyphenyl)pyrazine-2-carboxamide
CID 862102
3-(4-tert-butylphenyl)-3-(pyrazine-2-carbonylamino)propanoic acid
CID 119210009
N-[(4-ethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 760521
N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-6-carboxamide
CID 167894520
N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]thiomorpholine-4-carboxamide
CID 124847644
ethane;N-propan-2-ylpyrazine-2-carboxamide
CID 143147775
1-[[3-methoxy-2-(pyrazine-2-carbonylamino)propanoyl]amino]ethylboronic acid
CID 168920116
N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]pyrazine-2-carboxamide
CID 108796805

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide?
The IUPAC name of N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide (CID 124854277) is N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide is CCOc1ccc([C@H](COC)NC(=O)c2cnccn2)cc1.
What is the InChIKey of N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide?
The InChIKey is WXLWUCLXXAZAPC-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-3-22-13-6-4-12(5-7-13)15(11-21-2)19-16(20)14-10-17-8-9-18-14/h4-10,15H,3,11H2,1-2H3,(H,19,20)/t15-/m0/s1.
What are the key properties of N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide?
N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.99, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 124854277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).