4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one

C18H18N4O2 — CID 144516403

IUPAC4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one
SMILESCn1cc(-c2cc(OCC3CNC(=O)C3)c3cccnc3c2)cn1
InChIInChI=1S/C18H18N4O2/c1-22-10-14(9-21-22)13-6-16-15(3-2-4-19-16)17(7-13)24-11-12-5-18(23)20-8-12/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,20,23)
InChIKeyHYAXWXFDJQFNTD-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.15
Rot. Bonds4

About 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one

4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one (PubChem CID 144516403) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one
PubChem CID144516403
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one
SMILESCn1cc(-c2cc(OCC3CNC(=O)C3)c3cccnc3c2)cn1
InChIInChI=1S/C18H18N4O2/c1-22-10-14(9-21-22)13-6-16-15(3-2-4-19-16)17(7-13)24-11-12-5-18(23)20-8-12/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,20,23)
InChIKeyHYAXWXFDJQFNTD-UHFFFAOYSA-N
XLogP2.15
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-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

Related Compounds

4-[[7-(3,4-dimethoxyphenyl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 78045097
4-[(1R)-1-[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 122512500
4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one
CID 78045686
4-[[7-[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 123324119
4-[[7-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 144516347
ethane;5-[[7-(3,4,5-trimethoxyphenyl)quinolin-5-yl]oxymethyl]piperidin-2-one
CID 144516320
4-[[7-[6-(oxan-4-yloxy)-3-pyridinyl]quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 144516379
(6S)-6-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]-5-oxa-8-azaspiro[3.5]nonane
CID 176863329
(4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
CID 71240051
4-[[7-(4-fluoro-3-methoxyphenyl)-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 76687103
4-[[7-(4-methoxy-3-propan-2-yloxyphenyl)-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 77444763
4-[(1R)-1-[7-(1,5-dimethylpyrazol-4-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 149099758

Frequently Asked Questions

What is the IUPAC name of 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one?
The IUPAC name of 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one (CID 144516403) is 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one.
What is the SMILES notation for 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one?
The canonical SMILES for 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one is Cn1cc(-c2cc(OCC3CNC(=O)C3)c3cccnc3c2)cn1.
What is the InChIKey of 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one?
The InChIKey is HYAXWXFDJQFNTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-22-10-14(9-21-22)13-6-16-15(3-2-4-19-16)17(7-13)24-11-12-5-18(23)20-8-12/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,20,23).
What are the key properties of 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one?
4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one has a molecular weight of 322.37 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one is sourced from PubChem (CID 144516403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).