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

C19H24N4O4 — CID 162646996

IUPAC6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine
SMILESCCCN(c1cc(OC)c(OC)c(OC)c1)c1n[nH]c2nc(OC)ccc12
InChIInChI=1S/C19H24N4O4/c1-6-9-23(12-10-14(24-2)17(27-5)15(11-12)25-3)19-13-7-8-16(26-4)20-18(13)21-22-19/h7-8,10-11H,6,9H2,1-5H3,(H,20,21,22)
InChIKeyOMKBGAOZIFWZFT-UHFFFAOYSA-N
MW372.43 g/mol
LogP3.54
Rot. Bonds8

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

6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine (PubChem CID 162646996) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is 6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine.

Molecular Properties

Compound Name6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine
PubChem CID162646996
Molecular FormulaC19H24N4O4
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC Name6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine
SMILESCCCN(c1cc(OC)c(OC)c(OC)c1)c1n[nH]c2nc(OC)ccc12
InChIInChI=1S/C19H24N4O4/c1-6-9-23(12-10-14(24-2)17(27-5)15(11-12)25-3)19-13-7-8-16(26-4)20-18(13)21-22-19/h7-8,10-11H,6,9H2,1-5H3,(H,20,21,22)
InChIKeyOMKBGAOZIFWZFT-UHFFFAOYSA-N
XLogP3.54
TPSA81.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
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-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine?
The IUPAC name of 6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine (CID 162646996) is 6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine.
What is the SMILES notation for 6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine?
The canonical SMILES for 6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine is CCCN(c1cc(OC)c(OC)c(OC)c1)c1n[nH]c2nc(OC)ccc12.
What is the InChIKey of 6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine?
The InChIKey is OMKBGAOZIFWZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c1-6-9-23(12-10-14(24-2)17(27-5)15(11-12)25-3)19-13-7-8-16(26-4)20-18(13)21-22-19/h7-8,10-11H,6,9H2,1-5H3,(H,20,21,22).
What are the key properties of 6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine?
6-methoxy-N-propyl-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, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-propyl-N-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-amine is sourced from PubChem (CID 162646996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).