8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one

C22H17N5O — CID 127046085

IUPAC8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one
SMILESCn1c(=O)n(-c2ccccc2)c2c3cc(-c4ccc(N)nc4)ccc3ncc21
InChIInChI=1S/C22H17N5O/c1-26-19-13-24-18-9-7-14(15-8-10-20(23)25-12-15)11-17(18)21(19)27(22(26)28)16-5-3-2-4-6-16/h2-13H,1H3,(H2,23,25)
InChIKeyHCCIURCAYSLXJV-UHFFFAOYSA-N
MW367.41 g/mol
LogP3.52
Rot. Bonds2

About 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one

8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one (PubChem CID 127046085) has the molecular formula C22H17N5O and a molecular weight of 367.41 g/mol. Its IUPAC name is 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one
PubChem CID127046085
Molecular FormulaC22H17N5O
Molecular Weight367.41 g/mol
Exact Mass367.14
IUPAC Name8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one
SMILESCn1c(=O)n(-c2ccccc2)c2c3cc(-c4ccc(N)nc4)ccc3ncc21
InChIInChI=1S/C22H17N5O/c1-26-19-13-24-18-9-7-14(15-8-10-20(23)25-12-15)11-17(18)21(19)27(22(26)28)16-5-3-2-4-6-16/h2-13H,1H3,(H2,23,25)
InChIKeyHCCIURCAYSLXJV-UHFFFAOYSA-N
XLogP3.52
TPSA78.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one?
The IUPAC name of 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one (CID 127046085) is 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one is Cn1c(=O)n(-c2ccccc2)c2c3cc(-c4ccc(N)nc4)ccc3ncc21.
What is the InChIKey of 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one?
The InChIKey is HCCIURCAYSLXJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5O/c1-26-19-13-24-18-9-7-14(15-8-10-20(23)25-12-15)11-17(18)21(19)27(22(26)28)16-5-3-2-4-6-16/h2-13H,1H3,(H2,23,25).
What are the key properties of 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one?
8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one has a molecular weight of 367.41 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-amino-3-pyridinyl)-3-methyl-1-phenylimidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 127046085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).