bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium) — IUPAC name, SMILES, InChIKey & properties

Name: bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium) — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium)

bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium) (PubChem CID 157349069) has the molecular formula C73H123N19O4S5Y2-2 and a molecular weight of 1669.06 g/mol. Its IUPAC name is bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium).

Molecular Properties

Compound Name	bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium)
PubChem CID	157349069
Molecular Formula	C73H123N19O4S5Y2-2
Molecular Weight	1669.06 g/mol
Exact Mass	1667.67
IUPAC Name	bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium)
SMILES	CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccco1.Cc1cccs1.Cc1ccsc1.Cc1cnccn1.Cc1cncnc1.Cc1cnco1.Cc1cncs1.Cc1cnoc1.Cc1n[n-]c(C)n1.Cc1n[n-]c(C)n1.Cc1nnc(C)s1.Cc1nnsc1C.Cc1nonc1C.[Y].[Y]
InChI	InChI=1S/2C5H6N2.C5H6O.2C5H6S.2C4H6N3.C4H6N2O.2C4H6N2S.2C4H5NO.C4H5NS.8C2H6.2Y/c1-5-2-6-4-7-3-5;1-5-4-6-2-3-7-5;1-5-3-2-4-6-5;1-5-2-3-6-4-5;1-5-3-2-4-6-5;21-3-5-4(2)7-6-3;1-3-4(2)6-7-5-3;1-3-5-6-4(2)7-3;1-3-4(2)7-6-5-3;1-4-2-5-3-6-4;1-4-2-5-6-3-4;1-4-2-5-3-6-4;81-2;;/h22-4H,1H3;32-4H,1H3;51-2H3;32-3H,1H3;81-2H3;;/q;;;;;2-1;;;;;;;;;;;;;;;;
InChIKey	CUVQGNDIETYTME-UHFFFAOYSA-N
XLogP	21.99
TPSA	299.89 Å²
H-Bond Donors
H-Bond Acceptors	26
Rotatable Bonds
Heavy Atoms	103
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1669.06
LogP ≤ 5	21.99
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Analyze bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium)?

The IUPAC name of bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium) (CID 157349069) is bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium).

What is the SMILES notation for bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium)?

The canonical SMILES for bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium) is CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccco1.Cc1cccs1.Cc1ccsc1.Cc1cnccn1.Cc1cncnc1.Cc1cnco1.Cc1cncs1.Cc1cnoc1.Cc1n[n-]c(C)n1.Cc1n[n-]c(C)n1.Cc1nnc(C)s1.Cc1nnsc1C.Cc1nonc1C.[Y].[Y].

What is the InChIKey of bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium)?

The InChIKey is CUVQGNDIETYTME-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H6N2.C5H6O.2C5H6S.2C4H6N3.C4H6N2O.2C4H6N2S.2C4H5NO.C4H5NS.8C2H6.2Y/c1-5-2-6-4-7-3-5;1-5-4-6-2-3-7-5;1-5-3-2-4-6-5;1-5-2-3-6-4-5;1-5-3-2-4-6-5;2*1-3-5-4(2)7-6-3;1-3-4(2)6-7-5-3;1-3-5-6-4(2)7-3;1-3-4(2)7-6-5-3;1-4-2-5-3-6-4;1-4-2-5-6-3-4;1-4-2-5-3-6-4;8*1-2;;/h2*2-4H,1H3;3*2-4H,1H3;5*1-2H3;3*2-3H,1H3;8*1-2H3;;/q;;;;;2*-1;;;;;;;;;;;;;;;;.

What are the key properties of bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium)?

Where does this data come from?

All data for bis(3,5-dimethyl-2,4-diaza-1-azanidacyclopenta-2,4-diene);3,4-dimethyl-1,2,5-oxadiazole;2,5-dimethyl-1,3,4-thiadiazole;4,5-dimethylthiadiazole;ethane;2-methylfuran;4-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyrazine;5-methylpyrimidine;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;bis(yttrium) is sourced from PubChem (CID 157349069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).