N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide

C20H26N4O2 — CID 109274671

IUPACN-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
SMILESCOc1ccccc1CCNc1cnc(C(=O)NC2CCCCC2)cn1
InChIInChI=1S/C20H26N4O2/c1-26-18-10-6-5-7-15(18)11-12-21-19-14-22-17(13-23-19)20(25)24-16-8-3-2-4-9-16/h5-7,10,13-14,16H,2-4,8-9,11-12H2,1H3,(H,21,23)(H,24,25)
InChIKeyXCIGCUHSYTYQCS-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.20
Rot. Bonds7

About N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide

N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide (PubChem CID 109274671) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
PubChem CID109274671
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC NameN-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
SMILESCOc1ccccc1CCNc1cnc(C(=O)NC2CCCCC2)cn1
InChIInChI=1S/C20H26N4O2/c1-26-18-10-6-5-7-15(18)11-12-21-19-14-22-17(13-23-19)20(25)24-16-8-3-2-4-9-16/h5-7,10,13-14,16H,2-4,8-9,11-12H2,1H3,(H,21,23)(H,24,25)
InChIKeyXCIGCUHSYTYQCS-UHFFFAOYSA-N
XLogP3.20
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-5-[(2-methoxyphenyl)methylamino]pyrazine-2-carboxamide
CID 109274660
N-cycloheptyl-5-[(2-methoxyphenyl)methylamino]pyrazine-2-carboxamide
CID 109282300
N-cyclopropyl-5-[2-(2-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109271592
N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide
CID 109273887
N-[3-(dimethylamino)propyl]-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
CID 109277760
N-cycloheptyl-5-[(3,4-dimethoxyphenyl)methylamino]pyrazine-2-carboxamide
CID 109285915
N-cyclohexyl-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109274670
N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide
CID 109271032
N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide
CID 109273948
N-cyclopentyl-5-[(2-fluorophenyl)methylamino]pyrazine-2-carboxamide
CID 109273905
N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
CID 109284703
6-[2-(2-methoxyphenyl)ethylamino]-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133382556

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide?
The IUPAC name of N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide (CID 109274671) is N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide is COc1ccccc1CCNc1cnc(C(=O)NC2CCCCC2)cn1.
What is the InChIKey of N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide?
The InChIKey is XCIGCUHSYTYQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-26-18-10-6-5-7-15(18)11-12-21-19-14-22-17(13-23-19)20(25)24-16-8-3-2-4-9-16/h5-7,10,13-14,16H,2-4,8-9,11-12H2,1H3,(H,21,23)(H,24,25).
What are the key properties of N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide?
N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide has a molecular weight of 354.45 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide is sourced from PubChem (CID 109274671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).