3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine

C20H22N6O2 — CID 176913103

IUPAC3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine
SMILESNc1cc(COc2nc(-c3ccc(N4CCOCC4)cc3)cnc2N)ccn1
InChIInChI=1S/C20H22N6O2/c21-18-11-14(5-6-23-18)13-28-20-19(22)24-12-17(25-20)15-1-3-16(4-2-15)26-7-9-27-10-8-26/h1-6,11-12H,7-10,13H2,(H2,21,23)(H2,22,24)
InChIKeyXVUXHORLZJKLCU-UHFFFAOYSA-N
MW378.44 g/mol
LogP2.12
Rot. Bonds5

About 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine

3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine (PubChem CID 176913103) has the molecular formula C20H22N6O2 and a molecular weight of 378.44 g/mol. Its IUPAC name is 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine
PubChem CID176913103
Molecular FormulaC20H22N6O2
Molecular Weight378.44 g/mol
Exact Mass378.18
IUPAC Name3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine
SMILESNc1cc(COc2nc(-c3ccc(N4CCOCC4)cc3)cnc2N)ccn1
InChIInChI=1S/C20H22N6O2/c21-18-11-14(5-6-23-18)13-28-20-19(22)24-12-17(25-20)15-1-3-16(4-2-15)26-7-9-27-10-8-26/h1-6,11-12H,7-10,13H2,(H2,21,23)(H2,22,24)
InChIKeyXVUXHORLZJKLCU-UHFFFAOYSA-N
XLogP2.12
TPSA112.41 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.44
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

5-[4-(4-methylpiperazin-1-yl)phenyl]-3-[(2-morpholin-4-yl-4-pyridinyl)methoxy]pyrazin-2-amine
CID 176913197
5-[4-(4-methylpiperazin-1-yl)phenyl]-3-[(2-methyl-4-pyridinyl)methoxy]pyrazin-2-amine
CID 176913126
5-[4-(4-methylpiperazin-1-yl)phenyl]-3-[[2-(trifluoromethyl)-4-pyridinyl]methoxy]pyrazin-2-amine
CID 176913138
tert-butyl 4-[4-[5-amino-6-(pyridin-4-ylmethoxy)pyrazin-2-yl]phenyl]piperazine-1-carboxylate
CID 176913164
4-[4-(1,6-naphthyridin-7-yl)phenyl]morpholine
CID 91552475
[4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine
CID 177019277
2-[2-(4-morpholin-4-ylphenyl)-4-pyridinyl]-1-pyridin-2-ylethanone
CID 58585937
5-(5-morpholin-4-yl-2-pyridinyl)pyridin-2-amine
CID 172791169
1-(2-amino-4-pyridinyl)-3-N-(4-morpholin-4-ylphenyl)-1,2,4-triazole-3,5-diamine
CID 71036344
sodium 4-[[3-cyano-4-(furan-3-yl)-6-(4-morpholin-4-ylphenyl)-2-pyridinyl]oxymethyl]benzoate
CID 169428580
N-hydroxy-3-(4-morpholin-4-ylphenyl)quinoxaline-6-carboxamide
CID 162733690
4-(5-methyl-1,3-oxazol-4-yl)-6-(4-morpholin-4-ylphenyl)-2-(thiophen-3-ylmethoxy)pyridine-3-carbonitrile
CID 69098095

Frequently Asked Questions

What is the IUPAC name of 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine?
The IUPAC name of 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine (CID 176913103) is 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine.
What is the SMILES notation for 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine?
The canonical SMILES for 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine is Nc1cc(COc2nc(-c3ccc(N4CCOCC4)cc3)cnc2N)ccn1.
What is the InChIKey of 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine?
The InChIKey is XVUXHORLZJKLCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6O2/c21-18-11-14(5-6-23-18)13-28-20-19(22)24-12-17(25-20)15-1-3-16(4-2-15)26-7-9-27-10-8-26/h1-6,11-12H,7-10,13H2,(H2,21,23)(H2,22,24).
What are the key properties of 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine?
3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine has a molecular weight of 378.44 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-amino-4-pyridinyl)methoxy]-5-(4-morpholin-4-ylphenyl)pyrazin-2-amine is sourced from PubChem (CID 176913103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).