6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine

C23H20N8O — CID 118482365

IUPAC6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine
SMILESCc1cn2cc(Cn3cc4c(NCc5ccc6c(N)noc6c5)nccc4n3)ccc2n1
InChIInChI=1S/C23H20N8O/c1-14-10-30-11-16(3-5-21(30)27-14)12-31-13-18-19(28-31)6-7-25-23(18)26-9-15-2-4-17-20(8-15)32-29-22(17)24/h2-8,10-11,13H,9,12H2,1H3,(H2,24,29)(H,25,26)
InChIKeyJGMZHDGERPBHTQ-UHFFFAOYSA-N
MW424.47 g/mol
LogP3.77
Rot. Bonds5

About 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine

6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine (PubChem CID 118482365) has the molecular formula C23H20N8O and a molecular weight of 424.47 g/mol. Its IUPAC name is 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine.

Molecular Properties

Compound Name6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine
PubChem CID118482365
Molecular FormulaC23H20N8O
Molecular Weight424.47 g/mol
Exact Mass424.18
IUPAC Name6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine
SMILESCc1cn2cc(Cn3cc4c(NCc5ccc6c(N)noc6c5)nccc4n3)ccc2n1
InChIInChI=1S/C23H20N8O/c1-14-10-30-11-16(3-5-21(30)27-14)12-31-13-18-19(28-31)6-7-25-23(18)26-9-15-2-4-17-20(8-15)32-29-22(17)24/h2-8,10-11,13H,9,12H2,1H3,(H2,24,29)(H,25,26)
InChIKeyJGMZHDGERPBHTQ-UHFFFAOYSA-N
XLogP3.77
TPSA112.09 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.47
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine?
The IUPAC name of 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine (CID 118482365) is 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine.
What is the SMILES notation for 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine?
The canonical SMILES for 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine is Cc1cn2cc(Cn3cc4c(NCc5ccc6c(N)noc6c5)nccc4n3)ccc2n1.
What is the InChIKey of 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine?
The InChIKey is JGMZHDGERPBHTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N8O/c1-14-10-30-11-16(3-5-21(30)27-14)12-31-13-18-19(28-31)6-7-25-23(18)26-9-15-2-4-17-20(8-15)32-29-22(17)24/h2-8,10-11,13H,9,12H2,1H3,(H2,24,29)(H,25,26).
What are the key properties of 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine?
6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine has a molecular weight of 424.47 g/mol, XLogP of 3.77, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[[2-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]-1,2-benzoxazol-3-amine is sourced from PubChem (CID 118482365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).