6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one

C25H26N2O — CID 19854634

IUPAC6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(C(CCCc3ccccc3)Cc3cccnc3)ccc2N1
InChIInChI=1S/C25H26N2O/c28-25-14-12-23-17-22(11-13-24(23)27-25)21(16-20-9-5-15-26-18-20)10-4-8-19-6-2-1-3-7-19/h1-3,5-7,9,11,13,15,17-18,21H,4,8,10,12,14,16H2,(H,27,28)
InChIKeyHDNYUXQIPDSLOZ-UHFFFAOYSA-N
MW370.50 g/mol
LogP5.32
Rot. Bonds7

About 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one

6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 19854634) has the molecular formula C25H26N2O and a molecular weight of 370.50 g/mol. Its IUPAC name is 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID19854634
Molecular FormulaC25H26N2O
Molecular Weight370.50 g/mol
Exact Mass370.20
IUPAC Name6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(C(CCCc3ccccc3)Cc3cccnc3)ccc2N1
InChIInChI=1S/C25H26N2O/c28-25-14-12-23-17-22(11-13-24(23)27-25)21(16-20-9-5-15-26-18-20)10-4-8-19-6-2-1-3-7-19/h1-3,5-7,9,11,13,15,17-18,21H,4,8,10,12,14,16H2,(H,27,28)
InChIKeyHDNYUXQIPDSLOZ-UHFFFAOYSA-N
XLogP5.32
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.50
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one (CID 19854634) is 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(C(CCCc3ccccc3)Cc3cccnc3)ccc2N1.
What is the InChIKey of 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is HDNYUXQIPDSLOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O/c28-25-14-12-23-17-22(11-13-24(23)27-25)21(16-20-9-5-15-26-18-20)10-4-8-19-6-2-1-3-7-19/h1-3,5-7,9,11,13,15,17-18,21H,4,8,10,12,14,16H2,(H,27,28).
What are the key properties of 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one?
6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 370.50 g/mol, XLogP of 5.32, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-phenyl-1-pyridin-3-ylpentan-2-yl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 19854634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).