N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine

C19H19N5O2 — CID 25122244

IUPACN-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine
SMILESCCc1[nH]nc2ccc(Nc3nnc(Cc4cccc(OC)c4)o3)cc12
InChIInChI=1S/C19H19N5O2/c1-3-16-15-11-13(7-8-17(15)22-21-16)20-19-24-23-18(26-19)10-12-5-4-6-14(9-12)25-2/h4-9,11H,3,10H2,1-2H3,(H,20,24)(H,21,22)
InChIKeyYZSUISDNDWPVIY-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.85
Rot. Bonds6

About N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine

N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine (PubChem CID 25122244) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine
PubChem CID25122244
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC NameN-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine
SMILESCCc1[nH]nc2ccc(Nc3nnc(Cc4cccc(OC)c4)o3)cc12
InChIInChI=1S/C19H19N5O2/c1-3-16-15-11-13(7-8-17(15)22-21-16)20-19-24-23-18(26-19)10-12-5-4-6-14(9-12)25-2/h4-9,11H,3,10H2,1-2H3,(H,20,24)(H,21,22)
InChIKeyYZSUISDNDWPVIY-UHFFFAOYSA-N
XLogP3.85
TPSA88.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(3-ethyl-2H-indazol-5-yl)methyl]-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole
CID 58381514
N-(3-chloro-2H-indazol-5-yl)-5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-amine
CID 25121180
2-[(3-methoxyphenyl)methyl]-5-pyrrolidin-2-yl-1,3,4-oxadiazole
CID 82665656
N-(3-ethylphenyl)-5-[(2-methoxyethylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106968324
2-(3-methoxyphenyl)-N-[5-[(4-propan-2-ylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]acetamide
CID 43975016
2-(3-methoxyphenyl)-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]acetamide
CID 43975288
5-(chloromethyl)-N-(3-ethoxyphenyl)-1,3,4-oxadiazol-2-amine
CID 106957194
5-(ethylaminomethyl)-N-[3-(methoxymethyl)phenyl]-1,3,4-oxadiazol-2-amine
CID 106971403
2-(3-methoxyphenoxy)-N-[5-[(4-methylphenyl)methyl]-1,3,4-oxadiazol-2-yl]acetamide
CID 43973150
N-(3,4-dimethoxyphenyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106966611
2-(1H-indazol-5-ylmethyl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole;3-(1H-indazol-5-ylmethyl)-5-[(3-methoxyphenyl)methyl]-1,2,4-triazol-4-amine
CID 158635617
3-[(3-methoxyphenyl)methyl]-5-methyl-1H-pyrazole
CID 82076606

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine (CID 25122244) is N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine is CCc1[nH]nc2ccc(Nc3nnc(Cc4cccc(OC)c4)o3)cc12.
What is the InChIKey of N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine?
The InChIKey is YZSUISDNDWPVIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-3-16-15-11-13(7-8-17(15)22-21-16)20-19-24-23-18(26-19)10-12-5-4-6-14(9-12)25-2/h4-9,11H,3,10H2,1-2H3,(H,20,24)(H,21,22).
What are the key properties of N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine?
N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine has a molecular weight of 349.39 g/mol, XLogP of 3.85, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2H-indazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 25122244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).