3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide

C14H16N2O3 — CID 66487379

IUPAC3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide
SMILESCCOc1ccc2c(=O)ccn(CCC(N)=O)c2c1
InChIInChI=1S/C14H16N2O3/c1-2-19-10-3-4-11-12(9-10)16(7-5-13(11)17)8-6-14(15)18/h3-5,7,9H,2,6,8H2,1H3,(H2,15,18)
InChIKeyBKBQNEICBFGXNC-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.28
Rot. Bonds5

About 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide

3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide (PubChem CID 66487379) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide.

Molecular Properties

Compound Name3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide
PubChem CID66487379
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide
SMILESCCOc1ccc2c(=O)ccn(CCC(N)=O)c2c1
InChIInChI=1S/C14H16N2O3/c1-2-19-10-3-4-11-12(9-10)16(7-5-13(11)17)8-6-14(15)18/h3-5,7,9H,2,6,8H2,1H3,(H2,15,18)
InChIKeyBKBQNEICBFGXNC-UHFFFAOYSA-N
XLogP1.28
TPSA74.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(8-ethoxy-4-oxoquinolin-1-yl)propanamide
CID 66487335
3-(5-methoxyindol-1-yl)propanamide
CID 116619447
3-(7-chloro-4-oxoquinolin-1-yl)propanoic acid
CID 53264256
ethyl 2-(6,7-diethoxy-4-oxoquinolin-1-yl)acetate
CID 50877332
3-(4-propoxyindol-1-yl)propanamide
CID 83173818
3-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]propanamide
CID 30750718
4-(5-ethoxyindol-1-yl)butan-2-ol
CID 116624097
2,4-diethoxybenzamide
CID 17145726
3-(4-oxoquinolin-1-yl)propanoic acid
CID 53264528
3-(6-ethoxy-1-oxoisoquinolin-2-yl)-2-methylpropanethioamide
CID 82151791
3-(4-ethoxyphenyl)propanamide;hydrochloride
CID 172679140
2-(7-chloro-4-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)acetamide
CID 100738706

Frequently Asked Questions

What is the IUPAC name of 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide?
The IUPAC name of 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide (CID 66487379) is 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide.
What is the SMILES notation for 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide?
The canonical SMILES for 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide is CCOc1ccc2c(=O)ccn(CCC(N)=O)c2c1.
What is the InChIKey of 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide?
The InChIKey is BKBQNEICBFGXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-2-19-10-3-4-11-12(9-10)16(7-5-13(11)17)8-6-14(15)18/h3-5,7,9H,2,6,8H2,1H3,(H2,15,18).
What are the key properties of 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide?
3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide has a molecular weight of 260.29 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-ethoxy-4-oxoquinolin-1-yl)propanamide is sourced from PubChem (CID 66487379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).