2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine

C15H20N4O — CID 80653405

IUPAC2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine
SMILESCOc1ccccc1CC(C)N(C)c1cnc(N)cn1
InChIInChI=1S/C15H20N4O/c1-11(8-12-6-4-5-7-13(12)20-3)19(2)15-10-17-14(16)9-18-15/h4-7,9-11H,8H2,1-3H3,(H2,16,17)
InChIKeyZAJYSAHSSKWKLZ-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.13
Rot. Bonds5

About 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine

2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine (PubChem CID 80653405) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine.

Molecular Properties

Compound Name2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine
PubChem CID80653405
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine
SMILESCOc1ccccc1CC(C)N(C)c1cnc(N)cn1
InChIInChI=1S/C15H20N4O/c1-11(8-12-6-4-5-7-13(12)20-3)19(2)15-10-17-14(16)9-18-15/h4-7,9-11H,8H2,1-3H3,(H2,16,17)
InChIKeyZAJYSAHSSKWKLZ-UHFFFAOYSA-N
XLogP2.13
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N-methylpyridine-3,4-diamine
CID 65485063
5-[[1-(2-methoxyphenyl)propan-2-yl-methylamino]methyl]pyridin-2-amine
CID 115984767
5-bromo-4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N-methylpyrimidine-2,4-diamine
CID 80829894
2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine
CID 65484470
4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N,5-dimethylpyrimidine-4,6-diamine
CID 80829895
4-iodo-1-N-[1-(2-methoxyphenyl)propan-2-yl]-1-N-methylbenzene-1,2-diamine
CID 66080150
[2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-4-pyridinyl]methanol
CID 65487641
2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]pyridine-4-carbonitrile
CID 65485931
1-[2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-1,3-thiazol-5-yl]ethanol
CID 65488479
5-N-[1-(2-methoxyphenyl)propan-2-yl]-5-N,1,3-trimethylpyrazole-4,5-diamine
CID 65485261
2-iodo-1-N-[1-(2-methoxyphenyl)propan-2-yl]-1-N-methylbenzene-1,4-diamine
CID 66092748
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methyl-5-(methylaminomethyl)-1,3-thiazol-2-amine
CID 65486759

Frequently Asked Questions

What is the IUPAC name of 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine?
The IUPAC name of 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine (CID 80653405) is 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine.
What is the SMILES notation for 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine?
The canonical SMILES for 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine is COc1ccccc1CC(C)N(C)c1cnc(N)cn1.
What is the InChIKey of 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine?
The InChIKey is ZAJYSAHSSKWKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-11(8-12-6-4-5-7-13(12)20-3)19(2)15-10-17-14(16)9-18-15/h4-7,9-11H,8H2,1-3H3,(H2,16,17).
What are the key properties of 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine?
2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine has a molecular weight of 272.35 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine is sourced from PubChem (CID 80653405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).