2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide

C14H16N2O2 — CID 89210253

IUPAC2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide
SMILESC=CCC1C(=O)c2ccccc2NC1CC(N)=O
InChIInChI=1S/C14H16N2O2/c1-2-5-9-12(8-13(15)17)16-11-7-4-3-6-10(11)14(9)18/h2-4,6-7,9,12,16H,1,5,8H2,(H2,15,17)
InChIKeyRUCQZIVQCKJKJQ-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.73
Rot. Bonds4

About 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide

2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide (PubChem CID 89210253) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide
PubChem CID89210253
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide
SMILESC=CCC1C(=O)c2ccccc2NC1CC(N)=O
InChIInChI=1S/C14H16N2O2/c1-2-5-9-12(8-13(15)17)16-11-7-4-3-6-10(11)14(9)18/h2-4,6-7,9,12,16H,1,5,8H2,(H2,15,17)
InChIKeyRUCQZIVQCKJKJQ-UHFFFAOYSA-N
XLogP1.73
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(1,3-dioxoinden-2-yl)acetamide
CID 69094521
(2S,3S)-2,3-bis(prop-2-enyl)-1,2,3,4-tetrahydroquinoxaline
CID 743025
2-prop-2-enoxy-1,2-dihydroindol-3-one
CID 134960358
2-[(2S)-4-oxo-2,3-dihydro-1H-quinolin-2-yl]acetamide
CID 68879518
2-[(2R)-4-oxo-2,3-dihydro-1H-quinolin-2-yl]acetamide
CID 71035225
2-[4-[(2R)-4-oxo-3-prop-2-enyl-1,2-dihydroquinazolin-2-yl]phenoxy]acetamide
CID 26638727
4-[(1S)-1-amino-2-[(2S,3R)-2-prop-2-enyl-2,3-dihydro-1H-indol-3-yl]ethyl]hepta-1,6-dien-4-ol
CID 51409950
4-[(1S)-1-amino-2-[(2R,3S)-2-prop-2-enyl-2,3-dihydro-1H-indol-3-yl]ethyl]hepta-1,6-dien-4-ol
CID 40507502
(E)-carbamoyl-[[(3S)-2,4-dioxo-1H-quinolin-3-yl]methylidene]azanium
CID 171377140
2-amino-1,2-dihydroindol-3-one;hydrochloride
CID 146048624
2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
CID 693708
4-prop-2-enyl-3,4-dihydro-1H-quinazolin-2-one
CID 54023611

Frequently Asked Questions

What is the IUPAC name of 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide?
The IUPAC name of 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide (CID 89210253) is 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide.
What is the SMILES notation for 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide?
The canonical SMILES for 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide is C=CCC1C(=O)c2ccccc2NC1CC(N)=O.
What is the InChIKey of 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide?
The InChIKey is RUCQZIVQCKJKJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-2-5-9-12(8-13(15)17)16-11-7-4-3-6-10(11)14(9)18/h2-4,6-7,9,12,16H,1,5,8H2,(H2,15,17).
What are the key properties of 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide?
2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide has a molecular weight of 244.29 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxo-3-prop-2-enyl-2,3-dihydro-1H-quinolin-2-yl)acetamide is sourced from PubChem (CID 89210253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).