(R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol

C25H24N6O — CID 57193343

IUPAC(R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol
SMILESCCc1cn2c([C@H](O)c3ccc(-c4ccccc4-c4nn[nH]n4)cc3)c(C)cc(C)c2n1
InChIInChI=1S/C25H24N6O/c1-4-19-14-31-22(15(2)13-16(3)25(31)26-19)23(32)18-11-9-17(10-12-18)20-7-5-6-8-21(20)24-27-29-30-28-24/h5-14,23,32H,4H2,1-3H3,(H,27,28,29,30)/t23-/m1/s1
InChIKeyHJDHQYVYMOEGNJ-HSZRJFAPSA-N
MW424.51 g/mol
LogP4.44
Rot. Bonds5

About (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol

(R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol (PubChem CID 57193343) has the molecular formula C25H24N6O and a molecular weight of 424.51 g/mol. Its IUPAC name is (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol.

Molecular Properties

Compound Name(R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol
PubChem CID57193343
Molecular FormulaC25H24N6O
Molecular Weight424.51 g/mol
Exact Mass424.20
IUPAC Name(R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol
SMILESCCc1cn2c([C@H](O)c3ccc(-c4ccccc4-c4nn[nH]n4)cc3)c(C)cc(C)c2n1
InChIInChI=1S/C25H24N6O/c1-4-19-14-31-22(15(2)13-16(3)25(31)26-19)23(32)18-11-9-17(10-12-18)20-7-5-6-8-21(20)24-27-29-30-28-24/h5-14,23,32H,4H2,1-3H3,(H,27,28,29,30)/t23-/m1/s1
InChIKeyHJDHQYVYMOEGNJ-HSZRJFAPSA-N
XLogP4.44
TPSA91.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.51
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol?
The IUPAC name of (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol (CID 57193343) is (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol.
What is the SMILES notation for (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol?
The canonical SMILES for (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol is CCc1cn2c([C@H](O)c3ccc(-c4ccccc4-c4nn[nH]n4)cc3)c(C)cc(C)c2n1.
What is the InChIKey of (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol?
The InChIKey is HJDHQYVYMOEGNJ-HSZRJFAPSA-N. The full InChI is InChI=1S/C25H24N6O/c1-4-19-14-31-22(15(2)13-16(3)25(31)26-19)23(32)18-11-9-17(10-12-18)20-7-5-6-8-21(20)24-27-29-30-28-24/h5-14,23,32H,4H2,1-3H3,(H,27,28,29,30)/t23-/m1/s1.
What are the key properties of (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol?
(R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol has a molecular weight of 424.51 g/mol, XLogP of 4.44, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-5-yl)-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methanol is sourced from PubChem (CID 57193343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).