[3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol

C23H24N6O — CID 171034263

IUPAC[3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol
SMILESCCc1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(C3NNNN3)cn12
InChIInChI=1S/C23H24N6O/c1-2-19-21(24-20-14-13-16(15-29(19)20)22-25-27-28-26-22)23(30,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15,22,25-28,30H,2H2,1H3
InChIKeyLWYWCSCEFPWXIS-UHFFFAOYSA-N
MW400.49 g/mol
LogP2.30
Rot. Bonds5

About [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol

[3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol (PubChem CID 171034263) has the molecular formula C23H24N6O and a molecular weight of 400.49 g/mol. Its IUPAC name is [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol.

Molecular Properties

Compound Name[3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol
PubChem CID171034263
Molecular FormulaC23H24N6O
Molecular Weight400.49 g/mol
Exact Mass400.20
IUPAC Name[3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol
SMILESCCc1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(C3NNNN3)cn12
InChIInChI=1S/C23H24N6O/c1-2-19-21(24-20-14-13-16(15-29(19)20)22-25-27-28-26-22)23(30,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15,22,25-28,30H,2H2,1H3
InChIKeyLWYWCSCEFPWXIS-UHFFFAOYSA-N
XLogP2.30
TPSA85.65 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.49
LogP ≤ 52.30
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol?
The IUPAC name of [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol (CID 171034263) is [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol.
What is the SMILES notation for [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol?
The canonical SMILES for [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol is CCc1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(C3NNNN3)cn12.
What is the InChIKey of [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol?
The InChIKey is LWYWCSCEFPWXIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O/c1-2-19-21(24-20-14-13-16(15-29(19)20)22-25-27-28-26-22)23(30,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15,22,25-28,30H,2H2,1H3.
What are the key properties of [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol?
[3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol has a molecular weight of 400.49 g/mol, XLogP of 2.30, 5 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethyl-6-(tetrazolidin-5-yl)imidazo[1,2-a]pyridin-2-yl]-diphenylmethanol is sourced from PubChem (CID 171034263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).