7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one

C15H17N3O2 — CID 15005601

IUPAC7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one
SMILESO=c1[nH]c2cc3cc(CCCCCO)ccc3nc2[nH]1
InChIInChI=1S/C15H17N3O2/c19-7-3-1-2-4-10-5-6-12-11(8-10)9-13-14(16-12)18-15(20)17-13/h5-6,8-9,19H,1-4,7H2,(H2,16,17,18,20)
InChIKeyYUYJVWMDBVJKPA-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.11
Rot. Bonds5

About 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one

7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one (PubChem CID 15005601) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one.

Molecular Properties

Compound Name7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one
PubChem CID15005601
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one
SMILESO=c1[nH]c2cc3cc(CCCCCO)ccc3nc2[nH]1
InChIInChI=1S/C15H17N3O2/c19-7-3-1-2-4-10-5-6-12-11(8-10)9-13-14(16-12)18-15(20)17-13/h5-6,8-9,19H,1-4,7H2,(H2,16,17,18,20)
InChIKeyYUYJVWMDBVJKPA-UHFFFAOYSA-N
XLogP2.11
TPSA81.77 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]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 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one?
The IUPAC name of 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one (CID 15005601) is 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one.
What is the SMILES notation for 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one?
The canonical SMILES for 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one is O=c1[nH]c2cc3cc(CCCCCO)ccc3nc2[nH]1.
What is the InChIKey of 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one?
The InChIKey is YUYJVWMDBVJKPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c19-7-3-1-2-4-10-5-6-12-11(8-10)9-13-14(16-12)18-15(20)17-13/h5-6,8-9,19H,1-4,7H2,(H2,16,17,18,20).
What are the key properties of 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one?
7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one has a molecular weight of 271.32 g/mol, XLogP of 2.11, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one is sourced from PubChem (CID 15005601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).