2-methyl-1H-pyrrole;1,3-oxazole

C8H10N2O — CID 174860888

IUPAC2-methyl-1H-pyrrole;1,3-oxazole
SMILESCc1ccc[nH]1.c1cocn1
InChIInChI=1S/C5H7N.C3H3NO/c1-5-3-2-4-6-5;1-2-5-3-4-1/h2-4,6H,1H3;1-3H
InChIKeyZLPKRSQCXOUNNH-UHFFFAOYSA-N
MW150.18 g/mol
LogP2.00
Rot. Bonds

About 2-methyl-1H-pyrrole;1,3-oxazole

2-methyl-1H-pyrrole;1,3-oxazole (PubChem CID 174860888) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 2-methyl-1H-pyrrole;1,3-oxazole.

Molecular Properties

Compound Name2-methyl-1H-pyrrole;1,3-oxazole
PubChem CID174860888
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name2-methyl-1H-pyrrole;1,3-oxazole
SMILESCc1ccc[nH]1.c1cocn1
InChIInChI=1S/C5H7N.C3H3NO/c1-5-3-2-4-6-5;1-2-5-3-4-1/h2-4,6H,1H3;1-3H
InChIKeyZLPKRSQCXOUNNH-UHFFFAOYSA-N
XLogP2.00
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1H-pyrrole;1,3-oxazole?
The IUPAC name of 2-methyl-1H-pyrrole;1,3-oxazole (CID 174860888) is 2-methyl-1H-pyrrole;1,3-oxazole.
What is the SMILES notation for 2-methyl-1H-pyrrole;1,3-oxazole?
The canonical SMILES for 2-methyl-1H-pyrrole;1,3-oxazole is Cc1ccc[nH]1.c1cocn1.
What is the InChIKey of 2-methyl-1H-pyrrole;1,3-oxazole?
The InChIKey is ZLPKRSQCXOUNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N.C3H3NO/c1-5-3-2-4-6-5;1-2-5-3-4-1/h2-4,6H,1H3;1-3H.
What are the key properties of 2-methyl-1H-pyrrole;1,3-oxazole?
2-methyl-1H-pyrrole;1,3-oxazole has a molecular weight of 150.18 g/mol, XLogP of 2.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1H-pyrrole;1,3-oxazole is sourced from PubChem (CID 174860888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).