4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine

C20H22N6OS — CID 154378968

IUPAC4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine
SMILESCNC1(CCOC)C=CN=C(Nc2nc3ccc(-c4ccncc4)nc3s2)C1
InChIInChI=1S/C20H22N6OS/c1-21-20(8-12-27-2)7-11-23-17(13-20)26-19-25-16-4-3-15(24-18(16)28-19)14-5-9-22-10-6-14/h3-7,9-11,21H,8,12-13H2,1-2H3,(H,23,25,26)
InChIKeyWSSHTJOIOCSPSK-UHFFFAOYSA-N
MW394.50 g/mol
LogP3.48
Rot. Bonds6

About 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine

4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine (PubChem CID 154378968) has the molecular formula C20H22N6OS and a molecular weight of 394.50 g/mol. Its IUPAC name is 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine.

Molecular Properties

Compound Name4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine
PubChem CID154378968
Molecular FormulaC20H22N6OS
Molecular Weight394.50 g/mol
Exact Mass394.16
IUPAC Name4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine
SMILESCNC1(CCOC)C=CN=C(Nc2nc3ccc(-c4ccncc4)nc3s2)C1
InChIInChI=1S/C20H22N6OS/c1-21-20(8-12-27-2)7-11-23-17(13-20)26-19-25-16-4-3-15(24-18(16)28-19)14-5-9-22-10-6-14/h3-7,9-11,21H,8,12-13H2,1-2H3,(H,23,25,26)
InChIKeyWSSHTJOIOCSPSK-UHFFFAOYSA-N
XLogP3.48
TPSA84.32 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.50
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

N-[4-(propan-2-yloxymethyl)-2-pyridinyl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87944735
2-propan-2-yloxy-1-[4-[2-[(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)amino]-4-pyridinyl]piperazin-1-yl]ethanone
CID 87944549
N-[4-(4-methylsulfinylpiperazin-1-yl)-2-pyridinyl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 134422625
N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87944575
(2E,4E)-hepta-2,4-diene;N-methyl-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 143927839
4-(1-hydroxy-2-methylpropan-2-yl)-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)benzamide
CID 44548619
5-pyridin-4-yl-N-[4-[4-(3,3,3-trifluoropropyl)piperazin-1-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87944732
N-[4-[3-(dipropylamino)propyl]-2,3-dihydropyridin-6-yl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 135295398
5-(5-methyl-3-pyridinyl)-N-phenyl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 88563844
2-N-(2-methoxyethyl)-6-pyridin-4-ylpyridine-2,3-diamine
CID 20550365
[2-[[5-(1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]amino]-4-pyridinyl]methanol
CID 87945629
N-[4-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]-2-pyridinyl]-5-(1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87945605

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine?
The IUPAC name of 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine (CID 154378968) is 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine.
What is the SMILES notation for 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine?
The canonical SMILES for 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine is CNC1(CCOC)C=CN=C(Nc2nc3ccc(-c4ccncc4)nc3s2)C1.
What is the InChIKey of 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine?
The InChIKey is WSSHTJOIOCSPSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6OS/c1-21-20(8-12-27-2)7-11-23-17(13-20)26-19-25-16-4-3-15(24-18(16)28-19)14-5-9-22-10-6-14/h3-7,9-11,21H,8,12-13H2,1-2H3,(H,23,25,26).
What are the key properties of 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine?
4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine has a molecular weight of 394.50 g/mol, XLogP of 3.48, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine is sourced from PubChem (CID 154378968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).