N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine

C16H16N4O2 — CID 54613432

IUPACN-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine
SMILESCOc1ccc(Nc2nc3cccnc3nc2C)cc1OC
InChIInChI=1S/C16H16N4O2/c1-10-15(20-12-5-4-8-17-16(12)18-10)19-11-6-7-13(21-2)14(9-11)22-3/h4-9H,1-3H3,(H,19,20)
InChIKeyXLTDODGRNBKSAE-UHFFFAOYSA-N
MW296.33 g/mol
LogP3.09
Rot. Bonds4

About N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine

N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine (PubChem CID 54613432) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine
PubChem CID54613432
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC NameN-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine
SMILESCOc1ccc(Nc2nc3cccnc3nc2C)cc1OC
InChIInChI=1S/C16H16N4O2/c1-10-15(20-12-5-4-8-17-16(12)18-10)19-11-6-7-13(21-2)14(9-11)22-3/h4-9H,1-3H3,(H,19,20)
InChIKeyXLTDODGRNBKSAE-UHFFFAOYSA-N
XLogP3.09
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[2-(ethylamino)pyrido[3,2-d]pyrimidin-4-yl]-7-methoxy-3,4-dihydroquinoxalin-2(1H)-one
CID 156599543
4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328061
N*1*-{5-[2-(3,4,5-Trimethoxy-phenylamino)-pyrimidin-4-yl]-pyridin-2-yl}-ethane-1,2-diamine
CID 15550318
4-(2-Anilinopyridin-3-Yl)-N-(3,4,5-Trimethoxyphenyl)-1,3,5-Triazin-2-Amine
CID 16040288
N~2~-(3,4-dimethoxyphenyl)-N~4~-[2-(2-fluorophenyl)ethyl]-N~6~-quinolin-6-yl-1,3,5-triazine-2,4,6-triamine
CID 24767909
N~6~-(3,4-Dimethoxyphenyl)-2-(Morpholin-4-Yl)-4,5'-Bipyrimidine-2',6-Diamine
CID 59507470
5-Methyl-6-[(3,4,5-trimethoxyanilino)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
CID 456204
6,7-Dimethoxy-2-(4-pyrimidin-4-ylpiperazin-1-yl)quinazolin-4-amine
CID 13869539
2-[4-[4-(Dimethylamino)pyrimidin-2-yl]piperazin-1-yl]-6,7-dimethoxyquinolin-4-amine
CID 14069017
6-methoxy-2-pyridin-2-yl-1H-benzimidazole
CID 186762
4-(2-chloropyrido[3,2-d]pyrimidin-4-yl)-7-methoxy-3,4-dihydroquinoxalin-2(1H)-one
CID 139592925
6-(pyridin-4-yl)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 24879140

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine?
The IUPAC name of N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine (CID 54613432) is N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine is COc1ccc(Nc2nc3cccnc3nc2C)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine?
The InChIKey is XLTDODGRNBKSAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-10-15(20-12-5-4-8-17-16(12)18-10)19-11-6-7-13(21-2)14(9-11)22-3/h4-9H,1-3H3,(H,19,20).
What are the key properties of N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine?
N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine has a molecular weight of 296.33 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-3-methylpyrido[2,3-b]pyrazin-2-amine is sourced from PubChem (CID 54613432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).