6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine

C19H24N4O4 — CID 162671495

IUPAC6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine
SMILESCOc1ccc2c(N(c3cc(OC)c(OC)c(OC)c3)C(C)C)n[nH]c2n1
InChIInChI=1S/C19H24N4O4/c1-11(2)23(12-9-14(24-3)17(27-6)15(10-12)25-4)19-13-7-8-16(26-5)20-18(13)21-22-19/h7-11H,1-6H3,(H,20,21,22)
InChIKeyIFLNTJUCPQJHLP-UHFFFAOYSA-N
MW372.43 g/mol
LogP3.54
Rot. Bonds7

About 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine

6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine (PubChem CID 162671495) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine.

Molecular Properties

Compound Name6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine
PubChem CID162671495
Molecular FormulaC19H24N4O4
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC Name6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine
SMILESCOc1ccc2c(N(c3cc(OC)c(OC)c(OC)c3)C(C)C)n[nH]c2n1
InChIInChI=1S/C19H24N4O4/c1-11(2)23(12-9-14(24-3)17(27-6)15(10-12)25-4)19-13-7-8-16(26-5)20-18(13)21-22-19/h7-11H,1-6H3,(H,20,21,22)
InChIKeyIFLNTJUCPQJHLP-UHFFFAOYSA-N
XLogP3.54
TPSA81.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine?
The IUPAC name of 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine (CID 162671495) is 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine.
What is the SMILES notation for 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine?
The canonical SMILES for 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine is COc1ccc2c(N(c3cc(OC)c(OC)c(OC)c3)C(C)C)n[nH]c2n1.
What is the InChIKey of 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine?
The InChIKey is IFLNTJUCPQJHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c1-11(2)23(12-9-14(24-3)17(27-6)15(10-12)25-4)19-13-7-8-16(26-5)20-18(13)21-22-19/h7-11H,1-6H3,(H,20,21,22).
What are the key properties of 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine?
6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine has a molecular weight of 372.43 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine is sourced from PubChem (CID 162671495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).