5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C19H15N9O — CID 68570889

IUPAC5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESNc1nc2cccc(-c3ccc(OCc4ccc(-c5nn[nH]n5)nc4)cc3)n2n1
InChIInChI=1S/C19H15N9O/c20-19-22-17-3-1-2-16(28(17)25-19)13-5-7-14(8-6-13)29-11-12-4-9-15(21-10-12)18-23-26-27-24-18/h1-10H,11H2,(H2,20,25)(H,23,24,26,27)
InChIKeyGSXVUBVRLMOMGB-UHFFFAOYSA-N
MW385.39 g/mol
LogP2.13
Rot. Bonds5

About 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 68570889) has the molecular formula C19H15N9O and a molecular weight of 385.39 g/mol. Its IUPAC name is 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID68570889
Molecular FormulaC19H15N9O
Molecular Weight385.39 g/mol
Exact Mass385.14
IUPAC Name5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESNc1nc2cccc(-c3ccc(OCc4ccc(-c5nn[nH]n5)nc4)cc3)n2n1
InChIInChI=1S/C19H15N9O/c20-19-22-17-3-1-2-16(28(17)25-19)13-5-7-14(8-6-13)29-11-12-4-9-15(21-10-12)18-23-26-27-24-18/h1-10H,11H2,(H2,20,25)(H,23,24,26,27)
InChIKeyGSXVUBVRLMOMGB-UHFFFAOYSA-N
XLogP2.13
TPSA132.79 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.39
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 68570889) is 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is Nc1nc2cccc(-c3ccc(OCc4ccc(-c5nn[nH]n5)nc4)cc3)n2n1.
What is the InChIKey of 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is GSXVUBVRLMOMGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N9O/c20-19-22-17-3-1-2-16(28(17)25-19)13-5-7-14(8-6-13)29-11-12-4-9-15(21-10-12)18-23-26-27-24-18/h1-10H,11H2,(H2,20,25)(H,23,24,26,27).
What are the key properties of 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 385.39 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]methoxy]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 68570889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).