N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide

C14H15N3O3 — CID 24746893

IUPACN-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide
SMILESCOc1cc(CNC(=O)c2cnccn2)cc(OC)c1
InChIInChI=1S/C14H15N3O3/c1-19-11-5-10(6-12(7-11)20-2)8-17-14(18)13-9-15-3-4-16-13/h3-7,9H,8H2,1-2H3,(H,17,18)
InChIKeyYDVPWXFYIZDLJD-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.42
Rot. Bonds5

About N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide

N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide (PubChem CID 24746893) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide
PubChem CID24746893
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC NameN-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide
SMILESCOc1cc(CNC(=O)c2cnccn2)cc(OC)c1
InChIInChI=1S/C14H15N3O3/c1-19-11-5-10(6-12(7-11)20-2)8-17-14(18)13-9-15-3-4-16-13/h3-7,9H,8H2,1-2H3,(H,17,18)
InChIKeyYDVPWXFYIZDLJD-UHFFFAOYSA-N
XLogP1.42
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(6-methoxynaphthalen-2-yl)methyl]pyrazine-2-carboxamide
CID 51317152
N-[(3,5-dimethoxyphenyl)methyl]pyridine-2-carboxamide
CID 47024016
N-[(6-methoxy-3-pyridinyl)methyl]pyrazine-2-carboxamide
CID 51306029
N'-[3-(3,5-dimethoxyphenyl)propanoyl]pyrazine-2-carbohydrazide
CID 42016381
N-(1H-pyrazol-4-ylmethyl)pyrazine-2-carboxamide
CID 60736174
N-[(4-phenoxyphenyl)methyl]pyrazine-2-carboxamide
CID 110793747
N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl]pyrazine-2-carboxamide
CID 56809138
N-[2-[(4-methoxyphenyl)methylcarbamoyl]thiophen-3-yl]pyrazine-2-carboxamide
CID 53335911
N-[[4-(trifluoromethoxy)phenyl]methyl]pyrazine-2-carboxamide
CID 37039688
3-[(3,5-dimethoxyphenyl)methylcarbamoyl]-1-methylpyrazole-5-carboxylic acid
CID 19579262
N-[(3,5-dimethoxyphenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 46590121
methyl N-[2-(pyrazine-2-carbonylamino)ethyl]carbamate
CID 108574667

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide?
The IUPAC name of N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide (CID 24746893) is N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide is COc1cc(CNC(=O)c2cnccn2)cc(OC)c1.
What is the InChIKey of N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide?
The InChIKey is YDVPWXFYIZDLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-19-11-5-10(6-12(7-11)20-2)8-17-14(18)13-9-15-3-4-16-13/h3-7,9H,8H2,1-2H3,(H,17,18).
What are the key properties of N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide?
N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide has a molecular weight of 273.29 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 24746893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).