3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one

C23H24N4O2 — CID 1433253

IUPAC3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one
SMILESCOc1ccc2cc(-c3nc4ccccn4c3NC3CCCCC3)c(=O)[nH]c2c1
InChIInChI=1S/C23H24N4O2/c1-29-17-11-10-15-13-18(23(28)25-19(15)14-17)21-22(24-16-7-3-2-4-8-16)27-12-6-5-9-20(27)26-21/h5-6,9-14,16,24H,2-4,7-8H2,1H3,(H,25,28)
InChIKeyVFHYIKHDCGTUJC-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.60
Rot. Bonds4

About 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one

3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one (PubChem CID 1433253) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one
PubChem CID1433253
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one
SMILESCOc1ccc2cc(-c3nc4ccccn4c3NC3CCCCC3)c(=O)[nH]c2c1
InChIInChI=1S/C23H24N4O2/c1-29-17-11-10-15-13-18(23(28)25-19(15)14-17)21-22(24-16-7-3-2-4-8-16)27-12-6-5-9-20(27)26-21/h5-6,9-14,16,24H,2-4,7-8H2,1H3,(H,25,28)
InChIKeyVFHYIKHDCGTUJC-UHFFFAOYSA-N
XLogP4.60
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one?
The IUPAC name of 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one (CID 1433253) is 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one.
What is the SMILES notation for 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one?
The canonical SMILES for 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one is COc1ccc2cc(-c3nc4ccccn4c3NC3CCCCC3)c(=O)[nH]c2c1.
What is the InChIKey of 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one?
The InChIKey is VFHYIKHDCGTUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-29-17-11-10-15-13-18(23(28)25-19(15)14-17)21-22(24-16-7-3-2-4-8-16)27-12-6-5-9-20(27)26-21/h5-6,9-14,16,24H,2-4,7-8H2,1H3,(H,25,28).
What are the key properties of 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one?
3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one has a molecular weight of 388.47 g/mol, XLogP of 4.60, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one is sourced from PubChem (CID 1433253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).