3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one

C16H14N2O — CID 139729736

IUPAC3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one
SMILESCCc1cccnc1-c1cc2ccccc2[nH]c1=O
InChIInChI=1S/C16H14N2O/c1-2-11-7-5-9-17-15(11)13-10-12-6-3-4-8-14(12)18-16(13)19/h3-10H,2H2,1H3,(H,18,19)
InChIKeyDWILMBKZHWHZMO-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.15
Rot. Bonds2

About 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one

3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one (PubChem CID 139729736) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one.

Molecular Properties

Compound Name3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one
PubChem CID139729736
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one
SMILESCCc1cccnc1-c1cc2ccccc2[nH]c1=O
InChIInChI=1S/C16H14N2O/c1-2-11-7-5-9-17-15(11)13-10-12-6-3-4-8-14(12)18-16(13)19/h3-10H,2H2,1H3,(H,18,19)
InChIKeyDWILMBKZHWHZMO-UHFFFAOYSA-N
XLogP3.15
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one?
The IUPAC name of 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one (CID 139729736) is 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one.
What is the SMILES notation for 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one?
The canonical SMILES for 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one is CCc1cccnc1-c1cc2ccccc2[nH]c1=O.
What is the InChIKey of 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one?
The InChIKey is DWILMBKZHWHZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-2-11-7-5-9-17-15(11)13-10-12-6-3-4-8-14(12)18-16(13)19/h3-10H,2H2,1H3,(H,18,19).
What are the key properties of 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one?
3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one has a molecular weight of 250.30 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethyl-2-pyridinyl)-1H-quinolin-2-one is sourced from PubChem (CID 139729736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).