7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one

C21H24N4O2 — CID 171647793

IUPAC7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2ccc(OCCCCCNc3cnc4ccccn34)cc2N1
InChIInChI=1S/C21H24N4O2/c26-21-10-8-16-7-9-17(14-18(16)24-21)27-13-5-1-3-11-22-20-15-23-19-6-2-4-12-25(19)20/h2,4,6-7,9,12,14-15,22H,1,3,5,8,10-11,13H2,(H,24,26)
InChIKeyNHAWSNKUBWNCBV-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.88
Rot. Bonds8

About 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one

7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 171647793) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one
PubChem CID171647793
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2ccc(OCCCCCNc3cnc4ccccn34)cc2N1
InChIInChI=1S/C21H24N4O2/c26-21-10-8-16-7-9-17(14-18(16)24-21)27-13-5-1-3-11-22-20-15-23-19-6-2-4-12-25(19)20/h2,4,6-7,9,12,14-15,22H,1,3,5,8,10-11,13H2,(H,24,26)
InChIKeyNHAWSNKUBWNCBV-UHFFFAOYSA-N
XLogP3.88
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

7-[2-(2-oxo-1-pyridinyl)ethoxy]-3,4-dihydro-1H-quinolin-2-one
CID 114940102
7-(4-methoxybutoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114940015
4-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]butanal
CID 56851120
7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propoxy]-3,4-dihydro-1H-quinolin-2-one
CID 46829776
7-[4-[4-(2-fluorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one
CID 10715828
N,N-dibenzyl-11-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]undecanamide
CID 166437382
7-(2-pyridin-4-ylethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114940079
7-[4-[[2-(2-methylthiophen-3-yl)cyclopropyl]methylamino]butoxy]-3,4-dihydro-1H-quinolin-2-one
CID 175164276
7-(2-ethylsulfonylethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114940190
7-[5-[1-(3-chlorophenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazol-6-yl]pentoxy]-3,4-dihydro-1H-quinolin-2-one
CID 163985201
7-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methylamino]-3,4-dihydro-1H-quinolin-2-one
CID 138999881
7-(2-oxopropoxy)-3,4-dihydro-1H-quinolin-2-one
CID 112704281

Frequently Asked Questions

What is the IUPAC name of 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one (CID 171647793) is 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2ccc(OCCCCCNc3cnc4ccccn34)cc2N1.
What is the InChIKey of 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is NHAWSNKUBWNCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c26-21-10-8-16-7-9-17(14-18(16)24-21)27-13-5-1-3-11-22-20-15-23-19-6-2-4-12-25(19)20/h2,4,6-7,9,12,14-15,22H,1,3,5,8,10-11,13H2,(H,24,26).
What are the key properties of 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one?
7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 364.45 g/mol, XLogP of 3.88, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[5-(imidazo[1,2-a]pyridin-3-ylamino)pentoxy]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 171647793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).