4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide

C23H22N6O2 — CID 144691299

IUPAC4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide
SMILESCOc1cccc(-c2cn[nH]c2C(=O)NC2CCn3cc(-c4ccccc4)nc3C2)n1
InChIInChI=1S/C23H22N6O2/c1-31-21-9-5-8-18(27-21)17-13-24-28-22(17)23(30)25-16-10-11-29-14-19(26-20(29)12-16)15-6-3-2-4-7-15/h2-9,13-14,16H,10-12H2,1H3,(H,24,28)(H,25,30)
InChIKeyCGQNQLYSSLRELI-UHFFFAOYSA-N
MW414.47 g/mol
LogP3.09
Rot. Bonds5

About 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide

4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide (PubChem CID 144691299) has the molecular formula C23H22N6O2 and a molecular weight of 414.47 g/mol. Its IUPAC name is 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide
PubChem CID144691299
Molecular FormulaC23H22N6O2
Molecular Weight414.47 g/mol
Exact Mass414.18
IUPAC Name4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide
SMILESCOc1cccc(-c2cn[nH]c2C(=O)NC2CCn3cc(-c4ccccc4)nc3C2)n1
InChIInChI=1S/C23H22N6O2/c1-31-21-9-5-8-18(27-21)17-13-24-28-22(17)23(30)25-16-10-11-29-14-19(26-20(29)12-16)15-6-3-2-4-7-15/h2-9,13-14,16H,10-12H2,1H3,(H,24,28)(H,25,30)
InChIKeyCGQNQLYSSLRELI-UHFFFAOYSA-N
XLogP3.09
TPSA97.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.47
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide (CID 144691299) is 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide is COc1cccc(-c2cn[nH]c2C(=O)NC2CCn3cc(-c4ccccc4)nc3C2)n1.
What is the InChIKey of 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is CGQNQLYSSLRELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N6O2/c1-31-21-9-5-8-18(27-21)17-13-24-28-22(17)23(30)25-16-10-11-29-14-19(26-20(29)12-16)15-6-3-2-4-7-15/h2-9,13-14,16H,10-12H2,1H3,(H,24,28)(H,25,30).
What are the key properties of 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide?
4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 414.47 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxy-2-pyridinyl)-N-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 144691299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).