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

C24H26N6O2 — CID 171034275

IUPAC[3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol
SMILESCCc1c(C(O)(c2ccccc2)c2ccccc2)nn2cc(OC)c(C3NNNN3)cc12
InChIInChI=1S/C24H26N6O2/c1-3-18-20-14-19(23-25-28-29-26-23)21(32-2)15-30(20)27-22(18)24(31,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-15,23,25-26,28-29,31H,3H2,1-2H3
InChIKeyAMULPAJZDUZVEP-UHFFFAOYSA-N
MW430.51 g/mol
LogP2.31
Rot. Bonds6

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

[3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol (PubChem CID 171034275) has the molecular formula C24H26N6O2 and a molecular weight of 430.51 g/mol. Its IUPAC name is [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol.

Molecular Properties

Compound Name[3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol
PubChem CID171034275
Molecular FormulaC24H26N6O2
Molecular Weight430.51 g/mol
Exact Mass430.21
IUPAC Name[3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol
SMILESCCc1c(C(O)(c2ccccc2)c2ccccc2)nn2cc(OC)c(C3NNNN3)cc12
InChIInChI=1S/C24H26N6O2/c1-3-18-20-14-19(23-25-28-29-26-23)21(32-2)15-30(20)27-22(18)24(31,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-15,23,25-26,28-29,31H,3H2,1-2H3
InChIKeyAMULPAJZDUZVEP-UHFFFAOYSA-N
XLogP2.31
TPSA94.88 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.51
LogP ≤ 52.31
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol?
The IUPAC name of [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol (CID 171034275) is [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol.
What is the SMILES notation for [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol?
The canonical SMILES for [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol is CCc1c(C(O)(c2ccccc2)c2ccccc2)nn2cc(OC)c(C3NNNN3)cc12.
What is the InChIKey of [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol?
The InChIKey is AMULPAJZDUZVEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6O2/c1-3-18-20-14-19(23-25-28-29-26-23)21(32-2)15-30(20)27-22(18)24(31,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-15,23,25-26,28-29,31H,3H2,1-2H3.
What are the key properties of [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol?
[3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol has a molecular weight of 430.51 g/mol, XLogP of 2.31, 6 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethyl-6-methoxy-5-(tetrazolidin-5-yl)pyrazolo[1,5-a]pyridin-2-yl]-diphenylmethanol is sourced from PubChem (CID 171034275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).