4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one

C20H15N5O2 — CID 70707342

IUPAC4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one
SMILESCc1cc(=O)[nH]c2cc(-n3ccnc3-c3ccc(-c4ccn[nH]4)o3)ccc12
InChIInChI=1S/C20H15N5O2/c1-12-10-19(26)23-16-11-13(2-3-14(12)16)25-9-8-21-20(25)18-5-4-17(27-18)15-6-7-22-24-15/h2-11H,1H3,(H,22,24)(H,23,26)
InChIKeyHTSPANKIKPXSEX-UHFFFAOYSA-N
MW357.37 g/mol
LogP3.67
Rot. Bonds3

About 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one

4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one (PubChem CID 70707342) has the molecular formula C20H15N5O2 and a molecular weight of 357.37 g/mol. Its IUPAC name is 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one.

Molecular Properties

Compound Name4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one
PubChem CID70707342
Molecular FormulaC20H15N5O2
Molecular Weight357.37 g/mol
Exact Mass357.12
IUPAC Name4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one
SMILESCc1cc(=O)[nH]c2cc(-n3ccnc3-c3ccc(-c4ccn[nH]4)o3)ccc12
InChIInChI=1S/C20H15N5O2/c1-12-10-19(26)23-16-11-13(2-3-14(12)16)25-9-8-21-20(25)18-5-4-17(27-18)15-6-7-22-24-15/h2-11H,1H3,(H,22,24)(H,23,26)
InChIKeyHTSPANKIKPXSEX-UHFFFAOYSA-N
XLogP3.67
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one?
The IUPAC name of 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one (CID 70707342) is 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one.
What is the SMILES notation for 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one?
The canonical SMILES for 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one is Cc1cc(=O)[nH]c2cc(-n3ccnc3-c3ccc(-c4ccn[nH]4)o3)ccc12.
What is the InChIKey of 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one?
The InChIKey is HTSPANKIKPXSEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O2/c1-12-10-19(26)23-16-11-13(2-3-14(12)16)25-9-8-21-20(25)18-5-4-17(27-18)15-6-7-22-24-15/h2-11H,1H3,(H,22,24)(H,23,26).
What are the key properties of 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one?
4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one has a molecular weight of 357.37 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one is sourced from PubChem (CID 70707342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).