5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide

C19H26N4O3 — CID 109285735

IUPAC5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide
SMILESCCN(CC)c1cnc(C(=O)NCCc2ccc(OC)c(OC)c2)cn1
InChIInChI=1S/C19H26N4O3/c1-5-23(6-2)18-13-21-15(12-22-18)19(24)20-10-9-14-7-8-16(25-3)17(11-14)26-4/h7-8,11-13H,5-6,9-10H2,1-4H3,(H,20,24)
InChIKeyYFGJSSLTODLKQZ-UHFFFAOYSA-N
MW358.44 g/mol
LogP2.31
Rot. Bonds9

About 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide

5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide (PubChem CID 109285735) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide
PubChem CID109285735
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC Name5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide
SMILESCCN(CC)c1cnc(C(=O)NCCc2ccc(OC)c(OC)c2)cn1
InChIInChI=1S/C19H26N4O3/c1-5-23(6-2)18-13-21-15(12-22-18)19(24)20-10-9-14-7-8-16(25-3)17(11-14)26-4/h7-8,11-13H,5-6,9-10H2,1-4H3,(H,20,24)
InChIKeyYFGJSSLTODLKQZ-UHFFFAOYSA-N
XLogP2.31
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-5-(diethylamino)pyrazine-2-carboxamide
CID 109285769
1-[[6-(diethylamino)-3-pyridinyl]methyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]urea
CID 55769818
5-[2-(3-methoxy-4-methylphenyl)ethylcarbamoyl]pyrazine-2-carboxylic acid
CID 120685641
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-ethylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278606
5-[2-(3,4-dimethoxyphenyl)ethylamino]-N,N-diethylpyrazine-2-carboxamide
CID 109285752
N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19416871
6-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-2-carboxamide;hydrochloride
CID 119998901
5-[(3,4-dimethoxyphenyl)methylamino]-N-propylpyrazine-2-carboxamide
CID 109270813
2-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-N-(2-methoxyethyl)pyridine-2,6-dicarboxamide
CID 109095683
N-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-3-oxopropyl]-5-methylpyrazine-2-carboxamide
CID 42783474
5-(cycloheptylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109193613
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-1,3-oxazole-4-carboxamide
CID 30464265

Frequently Asked Questions

What is the IUPAC name of 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide?
The IUPAC name of 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide (CID 109285735) is 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide is CCN(CC)c1cnc(C(=O)NCCc2ccc(OC)c(OC)c2)cn1.
What is the InChIKey of 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide?
The InChIKey is YFGJSSLTODLKQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3/c1-5-23(6-2)18-13-21-15(12-22-18)19(24)20-10-9-14-7-8-16(25-3)17(11-14)26-4/h7-8,11-13H,5-6,9-10H2,1-4H3,(H,20,24).
What are the key properties of 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide?
5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide has a molecular weight of 358.44 g/mol, XLogP of 2.31, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(diethylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 109285735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).