3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine

C19H19N9O2 — CID 59137557

IUPAC3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine
SMILESCOc1cc(Nc2nccc(-c3[nH]c(C)nc3-c3cnc(N)c(OC)n3)n2)ccn1
InChIInChI=1S/C19H19N9O2/c1-10-24-15(16(25-10)13-9-23-17(20)18(27-13)30-3)12-5-7-22-19(28-12)26-11-4-6-21-14(8-11)29-2/h4-9H,1-3H3,(H2,20,23)(H,24,25)(H,21,22,26,28)
InChIKeyGDVYSHVRHMFKDB-UHFFFAOYSA-N
MW405.42 g/mol
LogP2.37
Rot. Bonds6

About 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine

3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine (PubChem CID 59137557) has the molecular formula C19H19N9O2 and a molecular weight of 405.42 g/mol. Its IUPAC name is 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine.

Molecular Properties

Compound Name3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine
PubChem CID59137557
Molecular FormulaC19H19N9O2
Molecular Weight405.42 g/mol
Exact Mass405.17
IUPAC Name3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine
SMILESCOc1cc(Nc2nccc(-c3[nH]c(C)nc3-c3cnc(N)c(OC)n3)n2)ccn1
InChIInChI=1S/C19H19N9O2/c1-10-24-15(16(25-10)13-9-23-17(20)18(27-13)30-3)12-5-7-22-19(28-12)26-11-4-6-21-14(8-11)29-2/h4-9H,1-3H3,(H2,20,23)(H,24,25)(H,21,22,26,28)
InChIKeyGDVYSHVRHMFKDB-UHFFFAOYSA-N
XLogP2.37
TPSA149.64 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.42
LogP ≤ 52.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

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Launch Full Analysis

Related Compounds

N-(2-methoxy-4-pyridinyl)-4-methylpyrimidin-2-amine
CID 66596222
1-[[4-[4-(5-amino-6-methoxypyrazin-2-yl)-2-tert-butyl-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propan-2-ylcarbamic acid
CID 66590928
4-[5-(6-amino-5-methoxy-3-pyridinyl)-2-methyl-3H-pyrrol-4-yl]-N-(2-methoxy-4-pyridinyl)pyrimidin-2-amine
CID 158517565
4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine
CID 170970558
N-[(2S)-1-[[4-[4-(5-amino-6-methoxypyrazin-2-yl)-2-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propan-2-yl]-2-methoxyacetamide
CID 59137303
4-[5-(6-amino-5-methoxy-3-pyridinyl)-2-tert-butyl-3-(2-trimethylsilylethoxymethyl)imidazol-4-yl]-N-(2-methoxy-4-pyridinyl)pyrimidin-2-amine
CID 66591312
4-(2-methoxy-4-pyridinyl)-N-pyrimidin-2-ylpyrimidin-2-amine
CID 170970741
5-chloro-2-N-(2-methoxy-4-pyridinyl)-4-N-(2-methylphenyl)pyrimidine-2,4-diamine
CID 155665823
N-[3-(2-aminoethoxy)phenyl]-4-(2-methoxy-4-pyridinyl)pyrimidin-2-amine
CID 170970806
5-(5-aminopent-1-ynyl)-2-N-(2-methoxy-4-pyridinyl)-4-N-methylpyrimidine-2,4-diamine
CID 90053452
methyl N-[1-[[4-[4-[5-amino-6-(trifluoromethoxy)pyrazin-2-yl]-2-tert-butyl-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propan-2-yl]carbamate
CID 66591212
5-(3,4-dimethylphenyl)-3-methoxypyrazin-2-amine
CID 178183758

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine?
The IUPAC name of 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine (CID 59137557) is 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine.
What is the SMILES notation for 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine?
The canonical SMILES for 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine is COc1cc(Nc2nccc(-c3[nH]c(C)nc3-c3cnc(N)c(OC)n3)n2)ccn1.
What is the InChIKey of 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine?
The InChIKey is GDVYSHVRHMFKDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N9O2/c1-10-24-15(16(25-10)13-9-23-17(20)18(27-13)30-3)12-5-7-22-19(28-12)26-11-4-6-21-14(8-11)29-2/h4-9H,1-3H3,(H2,20,23)(H,24,25)(H,21,22,26,28).
What are the key properties of 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine?
3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine has a molecular weight of 405.42 g/mol, XLogP of 2.37, 6 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-5-[5-[2-[(2-methoxy-4-pyridinyl)amino]pyrimidin-4-yl]-2-methyl-1H-imidazol-4-yl]pyrazin-2-amine is sourced from PubChem (CID 59137557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).