2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one

C23H24N10O2 — CID 138662575

IUPAC2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one
SMILESC[C@H](Nc1c(-c2nc3cc(N4CCOCC4)ncc3[nH]2)c(=O)[nH]c2cn(C)nc12)c1ncccn1
InChIInChI=1S/C23H24N10O2/c1-13(21-24-4-3-5-25-21)27-20-18(23(34)30-16-12-32(2)31-19(16)20)22-28-14-10-17(26-11-15(14)29-22)33-6-8-35-9-7-33/h3-5,10-13,27H,6-9H2,1-2H3,(H,28,29)(H,30,34)/t13-/m0/s1
InChIKeyQZYPCCCTXSBCNE-ZDUSSCGKSA-N
MW472.51 g/mol
LogP2.00
Rot. Bonds5

About 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one

2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one (PubChem CID 138662575) has the molecular formula C23H24N10O2 and a molecular weight of 472.51 g/mol. Its IUPAC name is 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one.

Molecular Properties

Compound Name2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one
PubChem CID138662575
Molecular FormulaC23H24N10O2
Molecular Weight472.51 g/mol
Exact Mass472.21
IUPAC Name2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one
SMILESC[C@H](Nc1c(-c2nc3cc(N4CCOCC4)ncc3[nH]2)c(=O)[nH]c2cn(C)nc12)c1ncccn1
InChIInChI=1S/C23H24N10O2/c1-13(21-24-4-3-5-25-21)27-20-18(23(34)30-16-12-32(2)31-19(16)20)22-28-14-10-17(26-11-15(14)29-22)33-6-8-35-9-7-33/h3-5,10-13,27H,6-9H2,1-2H3,(H,28,29)(H,30,34)/t13-/m0/s1
InChIKeyQZYPCCCTXSBCNE-ZDUSSCGKSA-N
XLogP2.00
TPSA142.53 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500472.51
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one?
The IUPAC name of 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one (CID 138662575) is 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one.
What is the SMILES notation for 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one?
The canonical SMILES for 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one is C[C@H](Nc1c(-c2nc3cc(N4CCOCC4)ncc3[nH]2)c(=O)[nH]c2cn(C)nc12)c1ncccn1.
What is the InChIKey of 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one?
The InChIKey is QZYPCCCTXSBCNE-ZDUSSCGKSA-N. The full InChI is InChI=1S/C23H24N10O2/c1-13(21-24-4-3-5-25-21)27-20-18(23(34)30-16-12-32(2)31-19(16)20)22-28-14-10-17(26-11-15(14)29-22)33-6-8-35-9-7-33/h3-5,10-13,27H,6-9H2,1-2H3,(H,28,29)(H,30,34)/t13-/m0/s1.
What are the key properties of 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one?
2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one has a molecular weight of 472.51 g/mol, XLogP of 2.00, 5 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one is sourced from PubChem (CID 138662575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).