2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol

C17H15N5O2 — CID 162150419

IUPAC2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol
SMILESCc1nc(-c2ccnc(-c3cc4c(ccn4CCO)cn3)c2)no1
InChIInChI=1S/C17H15N5O2/c1-11-20-17(21-24-11)12-2-4-18-14(8-12)15-9-16-13(10-19-15)3-5-22(16)6-7-23/h2-5,8-10,23H,6-7H2,1H3
InChIKeyJPNZGNGYTKOYKM-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.45
Rot. Bonds4

About 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol

2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol (PubChem CID 162150419) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol.

Molecular Properties

Compound Name2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol
PubChem CID162150419
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC Name2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol
SMILESCc1nc(-c2ccnc(-c3cc4c(ccn4CCO)cn3)c2)no1
InChIInChI=1S/C17H15N5O2/c1-11-20-17(21-24-11)12-2-4-18-14(8-12)15-9-16-13(10-19-15)3-5-22(16)6-7-23/h2-5,8-10,23H,6-7H2,1H3
InChIKeyJPNZGNGYTKOYKM-UHFFFAOYSA-N
XLogP2.45
TPSA89.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol with MolForge

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Related Compounds

5-methyl-3-[2-[1-(pyridin-2-ylmethyl)pyrrolo[3,2-c]pyridin-6-yl]-4-pyridinyl]-1,2,4-oxadiazole
CID 159511257
5-methyl-3-[2-[1-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridin-6-yl]-4-pyridinyl]-1,2,4-oxadiazole
CID 160800903
3-[2-(1,3-dimethylpyrrolo[3,2-c]pyridin-6-yl)-4-pyridinyl]-5-methyl-1,2,4-oxadiazole
CID 159277681
N,N-bis(2-hydroxyethyl)-1-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[2,3-c]pyridine-2-carboxamide
CID 167637658
8-(tert-butylamino)-2-(2-hydroxyethyl)-6-[[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]amino]-2,7-naphthyridin-1-one
CID 58167495
3-[2-(7-fluoroisoquinolin-3-yl)-4-pyridinyl]-5-methyl-1,2,4-oxadiazole
CID 159940619
5-methyl-3-(2-pyrazolo[1,5-a]pyrimidin-2-yl-4-pyridinyl)-1,2,4-oxadiazole
CID 159940616
4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine
CID 161477004
3-[2-[1-(3-methoxypropyl)pyrazolo[4,3-b]pyridin-3-yl]-4-pyridinyl]-5-methyl-1,2,4-oxadiazole
CID 167542563
ethane;5-methyl-3-[2-(1,5,6,7-tetramethylpyrazolo[4,5-b]pyridin-3-yl)-4-pyridinyl]-1,2,4-oxadiazole
CID 158723288
[1-butyl-5-[4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]-2-pyridinyl]pyrrolo[2,3-c]pyridin-3-yl]methanol
CID 155249796
2-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-4-carboxylic acid
CID 71289011

Frequently Asked Questions

What is the IUPAC name of 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol?
The IUPAC name of 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol (CID 162150419) is 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol.
What is the SMILES notation for 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol?
The canonical SMILES for 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol is Cc1nc(-c2ccnc(-c3cc4c(ccn4CCO)cn3)c2)no1.
What is the InChIKey of 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol?
The InChIKey is JPNZGNGYTKOYKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-11-20-17(21-24-11)12-2-4-18-14(8-12)15-9-16-13(10-19-15)3-5-22(16)6-7-23/h2-5,8-10,23H,6-7H2,1H3.
What are the key properties of 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol?
2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol has a molecular weight of 321.34 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]pyrrolo[3,2-c]pyridin-1-yl]ethanol is sourced from PubChem (CID 162150419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).