4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole

C15H19N5O4S — CID 174397632

IUPAC4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole
SMILESC1=CSCC1.C1=NCCO1.c1cnoc1.c1cocn1.c1conn1
InChIInChI=1S/C4H6S.C3H5NO.2C3H3NO.C2H2N2O/c1-2-4-5-3-1;2*1-2-5-3-4-1;1-2-4-5-3-1;1-2-5-4-3-1/h1,3H,2,4H2;3H,1-2H2;2*1-3H;1-2H
InChIKeyLIYZPLZXVVATBK-UHFFFAOYSA-N
MW365.42 g/mol
LogP3.10
Rot. Bonds

About 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole

4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole (PubChem CID 174397632) has the molecular formula C15H19N5O4S and a molecular weight of 365.42 g/mol. Its IUPAC name is 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole.

Molecular Properties

Compound Name4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole
PubChem CID174397632
Molecular FormulaC15H19N5O4S
Molecular Weight365.42 g/mol
Exact Mass365.12
IUPAC Name4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole
SMILESC1=CSCC1.C1=NCCO1.c1cnoc1.c1cocn1.c1conn1
InChIInChI=1S/C4H6S.C3H5NO.2C3H3NO.C2H2N2O/c1-2-4-5-3-1;2*1-2-5-3-4-1;1-2-4-5-3-1;1-2-5-4-3-1/h1,3H,2,4H2;3H,1-2H2;2*1-3H;1-2H
InChIKeyLIYZPLZXVVATBK-UHFFFAOYSA-N
XLogP3.10
TPSA112.57 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.42
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole?
The IUPAC name of 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole (CID 174397632) is 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole.
What is the SMILES notation for 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole?
The canonical SMILES for 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole is C1=CSCC1.C1=NCCO1.c1cnoc1.c1cocn1.c1conn1.
What is the InChIKey of 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole?
The InChIKey is LIYZPLZXVVATBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6S.C3H5NO.2C3H3NO.C2H2N2O/c1-2-4-5-3-1;2*1-2-5-3-4-1;1-2-4-5-3-1;1-2-5-4-3-1/h1,3H,2,4H2;3H,1-2H2;2*1-3H;1-2H.
What are the key properties of 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole?
4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole has a molecular weight of 365.42 g/mol, XLogP of 3.10, 0 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1,3-oxazole;2,3-dihydrothiophene;oxadiazole;1,2-oxazole;1,3-oxazole is sourced from PubChem (CID 174397632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).