6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide

C20H19N5O3 — CID 175559978

IUPAC6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide
SMILESCCOc1ccc(-c2cncc(C(=O)NN=Cc3ccnc(OC)c3)n2)cc1
InChIInChI=1S/C20H19N5O3/c1-3-28-16-6-4-15(5-7-16)17-12-21-13-18(24-17)20(26)25-23-11-14-8-9-22-19(10-14)27-2/h4-13H,3H2,1-2H3,(H,25,26)
InChIKeyUDSOAJREUATRON-UHFFFAOYSA-N
MW377.40 g/mol
LogP2.71
Rot. Bonds7

About 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide

6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide (PubChem CID 175559978) has the molecular formula C20H19N5O3 and a molecular weight of 377.40 g/mol. Its IUPAC name is 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide
PubChem CID175559978
Molecular FormulaC20H19N5O3
Molecular Weight377.40 g/mol
Exact Mass377.15
IUPAC Name6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide
SMILESCCOc1ccc(-c2cncc(C(=O)NN=Cc3ccnc(OC)c3)n2)cc1
InChIInChI=1S/C20H19N5O3/c1-3-28-16-6-4-15(5-7-16)17-12-21-13-18(24-17)20(26)25-23-11-14-8-9-22-19(10-14)27-2/h4-13H,3H2,1-2H3,(H,25,26)
InChIKeyUDSOAJREUATRON-UHFFFAOYSA-N
XLogP2.71
TPSA98.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.40
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-6-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 171771767
6-(4-ethoxyphenyl)-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 171771765
6-(4-ethoxyphenyl)-N-[(4-fluoro-3,5-dimethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 175559902
N-[(2,5-dimethoxyphenyl)methylideneamino]-6-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 175559864
6-(4-butoxyphenyl)-N-[(3,5-dimethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 175559912
N-[(E)-[3-[2-(dimethylamino)ethoxy]-5-methoxyphenyl]methylideneamino]-6-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 167450813
[[3-[(E)-[[6-(4-ethoxyphenyl)pyrazine-2-carbonyl]hydrazinylidene]methyl]benzoyl]amino]methanesulfinate
CID 174239632
N-[(3-bromophenyl)methylideneamino]-6-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 175559898
6-(4-ethoxyphenyl)-N-[(E)-(5-methoxy-1,3-benzoxazol-7-yl)methylideneamino]pyrazine-2-carboxamide
CID 167450671
6-(4-methoxyphenyl)-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 167450912
6-[4-(cyclopropylmethoxy)phenyl]-N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 167450595
N-[(E)-(4-chlorophenyl)methylideneamino]-6-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 167450793

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide?
The IUPAC name of 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide (CID 175559978) is 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide.
What is the SMILES notation for 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide?
The canonical SMILES for 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide is CCOc1ccc(-c2cncc(C(=O)NN=Cc3ccnc(OC)c3)n2)cc1.
What is the InChIKey of 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide?
The InChIKey is UDSOAJREUATRON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O3/c1-3-28-16-6-4-15(5-7-16)17-12-21-13-18(24-17)20(26)25-23-11-14-8-9-22-19(10-14)27-2/h4-13H,3H2,1-2H3,(H,25,26).
What are the key properties of 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide?
6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide has a molecular weight of 377.40 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methylideneamino]pyrazine-2-carboxamide is sourced from PubChem (CID 175559978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).