8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine

C19H21N5O2 — CID 118169522

IUPAC8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
SMILESCOc1ccc(C2c3nnnn3CCN2Cc2cccc(OC)c2)cc1
InChIInChI=1S/C19H21N5O2/c1-25-16-8-6-15(7-9-16)18-19-20-21-22-24(19)11-10-23(18)13-14-4-3-5-17(12-14)26-2/h3-9,12,18H,10-11,13H2,1-2H3
InChIKeyILVLYCDYZYZQTL-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.30
Rot. Bonds5

About 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine

8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine (PubChem CID 118169522) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
PubChem CID118169522
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
SMILESCOc1ccc(C2c3nnnn3CCN2Cc2cccc(OC)c2)cc1
InChIInChI=1S/C19H21N5O2/c1-25-16-8-6-15(7-9-16)18-19-20-21-22-24(19)11-10-23(18)13-14-4-3-5-17(12-14)26-2/h3-9,12,18H,10-11,13H2,1-2H3
InChIKeyILVLYCDYZYZQTL-UHFFFAOYSA-N
XLogP2.30
TPSA65.30 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

7-[(3-bromophenyl)methyl]-8-(4-ethoxyphenyl)-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
CID 118169370
7-[(3-bromophenyl)methyl]-8-(4-propan-2-yloxyphenyl)-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
CID 118169398
7-[(3-methylphenyl)methyl]-8-phenyl-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
CID 118169409
7-[(3-bromophenyl)methyl]-8-(3,5-dimethylphenyl)-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
CID 133081657
(8R)-8-(3-fluorophenyl)-7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
CID 118169441
(2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine
CID 92569268
1-[(3-methoxyphenyl)methyl]-4-[(4-methoxyphenyl)methyl]piperazine
CID 2873492
1-(4-ethylphenyl)-2-[(3-methoxyphenyl)methyl]-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine
CID 46154428
2-(3,4-dimethoxyphenyl)-1-[(3-methoxyphenyl)methyl]pyrrolidine
CID 134001112
(2R)-2-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine
CID 92569271
4-[1-[(3-methoxyphenyl)methyl]pyrrolidin-2-yl]pyridine
CID 122138322
7-[(4-ethoxyphenyl)methyl]-8-(1-phenyl-3-propan-2-ylpyrazol-4-yl)-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine
CID 118169368

Frequently Asked Questions

What is the IUPAC name of 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine?
The IUPAC name of 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine (CID 118169522) is 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine.
What is the SMILES notation for 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine?
The canonical SMILES for 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine is COc1ccc(C2c3nnnn3CCN2Cc2cccc(OC)c2)cc1.
What is the InChIKey of 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine?
The InChIKey is ILVLYCDYZYZQTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-25-16-8-6-15(7-9-16)18-19-20-21-22-24(19)11-10-23(18)13-14-4-3-5-17(12-14)26-2/h3-9,12,18H,10-11,13H2,1-2H3.
What are the key properties of 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine?
8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine has a molecular weight of 351.41 g/mol, XLogP of 2.30, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-methoxyphenyl)-7-[(3-methoxyphenyl)methyl]-6,8-dihydro-5H-tetrazolo[1,5-a]pyrazine is sourced from PubChem (CID 118169522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).