benzene;furan;pyridine;1H-pyrrole;thiophene

C23H24N2OS — CID 159309311

IUPACbenzene;furan;pyridine;1H-pyrrole;thiophene
SMILESc1cc[nH]c1.c1ccccc1.c1ccncc1.c1ccoc1.c1ccsc1
InChIInChI=1S/C6H6.C5H5N.C4H5N.C4H4O.C4H4S/c2*1-2-4-6-5-3-1;3*1-2-4-5-3-1/h1-6H;1-5H;1-5H;2*1-4H
InChIKeyLCIGKOZPMKYIDQ-UHFFFAOYSA-N
MW376.53 g/mol
LogP6.81
Rot. Bonds

About benzene;furan;pyridine;1H-pyrrole;thiophene

benzene;furan;pyridine;1H-pyrrole;thiophene (PubChem CID 159309311) has the molecular formula C23H24N2OS and a molecular weight of 376.53 g/mol. Its IUPAC name is benzene;furan;pyridine;1H-pyrrole;thiophene.

Molecular Properties

Compound Namebenzene;furan;pyridine;1H-pyrrole;thiophene
PubChem CID159309311
Molecular FormulaC23H24N2OS
Molecular Weight376.53 g/mol
Exact Mass376.16
IUPAC Namebenzene;furan;pyridine;1H-pyrrole;thiophene
SMILESc1cc[nH]c1.c1ccccc1.c1ccncc1.c1ccoc1.c1ccsc1
InChIInChI=1S/C6H6.C5H5N.C4H5N.C4H4O.C4H4S/c2*1-2-4-6-5-3-1;3*1-2-4-5-3-1/h1-6H;1-5H;1-5H;2*1-4H
InChIKeyLCIGKOZPMKYIDQ-UHFFFAOYSA-N
XLogP6.81
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.53
LogP ≤ 56.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of benzene;furan;pyridine;1H-pyrrole;thiophene?
The IUPAC name of benzene;furan;pyridine;1H-pyrrole;thiophene (CID 159309311) is benzene;furan;pyridine;1H-pyrrole;thiophene.
What is the SMILES notation for benzene;furan;pyridine;1H-pyrrole;thiophene?
The canonical SMILES for benzene;furan;pyridine;1H-pyrrole;thiophene is c1cc[nH]c1.c1ccccc1.c1ccncc1.c1ccoc1.c1ccsc1.
What is the InChIKey of benzene;furan;pyridine;1H-pyrrole;thiophene?
The InChIKey is LCIGKOZPMKYIDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6.C5H5N.C4H5N.C4H4O.C4H4S/c2*1-2-4-6-5-3-1;3*1-2-4-5-3-1/h1-6H;1-5H;1-5H;2*1-4H.
What are the key properties of benzene;furan;pyridine;1H-pyrrole;thiophene?
benzene;furan;pyridine;1H-pyrrole;thiophene has a molecular weight of 376.53 g/mol, XLogP of 6.81, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;furan;pyridine;1H-pyrrole;thiophene is sourced from PubChem (CID 159309311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).