N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide

C20H26N4O — CID 109288895

IUPACN-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide
SMILESCCN(C(=O)c1cnc(N2CCCC(C)C2)cn1)c1cccc(C)c1
InChIInChI=1S/C20H26N4O/c1-4-24(17-9-5-7-15(2)11-17)20(25)18-12-22-19(13-21-18)23-10-6-8-16(3)14-23/h5,7,9,11-13,16H,4,6,8,10,14H2,1-3H3
InChIKeyCSUHEKLURMPVOF-UHFFFAOYSA-N
MW338.46 g/mol
LogP3.69
Rot. Bonds4

About N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide

N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide (PubChem CID 109288895) has the molecular formula C20H26N4O and a molecular weight of 338.46 g/mol. Its IUPAC name is N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide
PubChem CID109288895
Molecular FormulaC20H26N4O
Molecular Weight338.46 g/mol
Exact Mass338.21
IUPAC NameN-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide
SMILESCCN(C(=O)c1cnc(N2CCCC(C)C2)cn1)c1cccc(C)c1
InChIInChI=1S/C20H26N4O/c1-4-24(17-9-5-7-15(2)11-17)20(25)18-12-22-19(13-21-18)23-10-6-8-16(3)14-23/h5,7,9,11-13,16H,4,6,8,10,14H2,1-3H3
InChIKeyCSUHEKLURMPVOF-UHFFFAOYSA-N
XLogP3.69
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(azepan-1-yl)-N-ethyl-N-phenylpyrazine-2-carboxamide
CID 109289326
N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide
CID 109182897
N-ethyl-N-(3-methylphenyl)-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109056588
N-(2,6-diethylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109288815
N-ethyl-N-(3-methylphenyl)-5-(4-methylpiperazin-1-yl)pyridine-2-carboxamide
CID 109186597
N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide
CID 109240823
N-ethyl-N-(3-methylphenyl)-5-(propylamino)pyrazine-2-carboxamide
CID 109271148
5-(tert-butylamino)-N-ethyl-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109287454
N-ethyl-5-(3-methylanilino)-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109290010
(4-methylpiperidin-1-yl)-[5-(3-methylpiperidin-1-yl)pyrazin-2-yl]methanone
CID 109275074
(4-benzylpiperidin-1-yl)-[5-(3-methylpiperidin-1-yl)pyrazin-2-yl]methanone
CID 109288459
N-ethyl-N-(3-methylphenyl)-2-(3-methylpiperidin-1-yl)pyrimidin-4-amine
CID 112901156

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide?
The IUPAC name of N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide (CID 109288895) is N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide is CCN(C(=O)c1cnc(N2CCCC(C)C2)cn1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide?
The InChIKey is CSUHEKLURMPVOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c1-4-24(17-9-5-7-15(2)11-17)20(25)18-12-22-19(13-21-18)23-10-6-8-16(3)14-23/h5,7,9,11-13,16H,4,6,8,10,14H2,1-3H3.
What are the key properties of N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide?
N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide has a molecular weight of 338.46 g/mol, XLogP of 3.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 109288895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).