5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide

C19H25N5O2 — CID 109278676

IUPAC5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
SMILESCCN1CCN(c2cnc(C(=O)Nc3cc(C)ccc3OC)cn2)CC1
InChIInChI=1S/C19H25N5O2/c1-4-23-7-9-24(10-8-23)18-13-20-16(12-21-18)19(25)22-15-11-14(2)5-6-17(15)26-3/h5-6,11-13H,4,7-10H2,1-3H3,(H,22,25)
InChIKeyPRMXNDDYYLHJMR-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.19
Rot. Bonds5

About 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide

5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide (PubChem CID 109278676) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
PubChem CID109278676
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Name5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
SMILESCCN1CCN(c2cnc(C(=O)Nc3cc(C)ccc3OC)cn2)CC1
InChIInChI=1S/C19H25N5O2/c1-4-23-7-9-24(10-8-23)18-13-20-16(12-21-18)19(25)22-15-11-14(2)5-6-17(15)26-3/h5-6,11-13H,4,7-10H2,1-3H3,(H,22,25)
InChIKeyPRMXNDDYYLHJMR-UHFFFAOYSA-N
XLogP2.19
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide (CID 109278676) is 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide is CCN1CCN(c2cnc(C(=O)Nc3cc(C)ccc3OC)cn2)CC1.
What is the InChIKey of 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide?
The InChIKey is PRMXNDDYYLHJMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-4-23-7-9-24(10-8-23)18-13-20-16(12-21-18)19(25)22-15-11-14(2)5-6-17(15)26-3/h5-6,11-13H,4,7-10H2,1-3H3,(H,22,25).
What are the key properties of 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide?
5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109278676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).