6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine

C21H23N7O — CID 134300799

IUPAC6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(NC4CCNCC4)n3)n2cc1-c1cn[nH]c1
InChIInChI=1S/C21H23N7O/c1-29-19-9-21-23-12-18(28(21)13-16(19)14-10-24-25-11-14)17-3-2-4-20(27-17)26-15-5-7-22-8-6-15/h2-4,9-13,15,22H,5-8H2,1H3,(H,24,25)(H,26,27)
InChIKeyVGCUMSVAVFGGAF-UHFFFAOYSA-N
MW389.46 g/mol
LogP2.96
Rot. Bonds5

About 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine

6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine (PubChem CID 134300799) has the molecular formula C21H23N7O and a molecular weight of 389.46 g/mol. Its IUPAC name is 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine.

Molecular Properties

Compound Name6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine
PubChem CID134300799
Molecular FormulaC21H23N7O
Molecular Weight389.46 g/mol
Exact Mass389.20
IUPAC Name6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(NC4CCNCC4)n3)n2cc1-c1cn[nH]c1
InChIInChI=1S/C21H23N7O/c1-29-19-9-21-23-12-18(28(21)13-16(19)14-10-24-25-11-14)17-3-2-4-20(27-17)26-15-5-7-22-8-6-15/h2-4,9-13,15,22H,5-8H2,1H3,(H,24,25)(H,26,27)
InChIKeyVGCUMSVAVFGGAF-UHFFFAOYSA-N
XLogP2.96
TPSA92.16 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 52.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine?
The IUPAC name of 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine (CID 134300799) is 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine.
What is the SMILES notation for 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine?
The canonical SMILES for 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine is COc1cc2ncc(-c3cccc(NC4CCNCC4)n3)n2cc1-c1cn[nH]c1.
What is the InChIKey of 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine?
The InChIKey is VGCUMSVAVFGGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N7O/c1-29-19-9-21-23-12-18(28(21)13-16(19)14-10-24-25-11-14)17-3-2-4-20(27-17)26-15-5-7-22-8-6-15/h2-4,9-13,15,22H,5-8H2,1H3,(H,24,25)(H,26,27).
What are the key properties of 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine?
6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine has a molecular weight of 389.46 g/mol, XLogP of 2.96, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[7-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-N-piperidin-4-ylpyridin-2-amine is sourced from PubChem (CID 134300799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).