3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide

C17H23N3O4 — CID 100829038

IUPAC3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCNC(=O)COc1cccc2c1NC(=O)CC2
InChIInChI=1S/C17H23N3O4/c1-11(2)19-15(22)8-9-18-16(23)10-24-13-5-3-4-12-6-7-14(21)20-17(12)13/h3-5,11H,6-10H2,1-2H3,(H,18,23)(H,19,22)(H,20,21)
InChIKeyQQYOZBQWZHRIPM-UHFFFAOYSA-N
MW333.39 g/mol
LogP0.98
Rot. Bonds7

About 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide

3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide (PubChem CID 100829038) has the molecular formula C17H23N3O4 and a molecular weight of 333.39 g/mol. Its IUPAC name is 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide
PubChem CID100829038
Molecular FormulaC17H23N3O4
Molecular Weight333.39 g/mol
Exact Mass333.17
IUPAC Name3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCNC(=O)COc1cccc2c1NC(=O)CC2
InChIInChI=1S/C17H23N3O4/c1-11(2)19-15(22)8-9-18-16(23)10-24-13-5-3-4-12-6-7-14(21)20-17(12)13/h3-5,11H,6-10H2,1-2H3,(H,18,23)(H,19,22)(H,20,21)
InChIKeyQQYOZBQWZHRIPM-UHFFFAOYSA-N
XLogP0.98
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 50.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide with MolForge

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Related Compounds

N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetamide
CID 100829037
N-(5-methyl-1,3-thiazol-2-yl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetamide
CID 100829026
N-pentan-2-yl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)acetamide
CID 61026655
8-(3-chloro-2-hydroxypropoxy)-3,4-dihydro-1H-quinolin-2-one
CID 20540658
8-hydroxy-3,4-dihydro-1H-quinolin-2-one;methane;8-(methoxymethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 145256308
8-[3-[(2-hydroxycyclohexyl)amino]propoxy]-3,4-dihydro-1H-quinolin-2-one
CID 20555988
2-[[2-(2,3-dimethylphenoxy)acetyl]amino]-N-propan-2-ylacetamide
CID 9300913
3-(2-naphthalen-1-yloxyethylcarbamoylamino)-N-propan-2-ylpropanamide
CID 60544727
2-hydroxy-3-methoxy-N-[3-oxo-3-(propan-2-ylamino)propyl]benzamide
CID 115670745
2-(2-amino-3-hydroxyphenoxy)-N-propan-2-ylacetamide
CID 114764237
N-ethyl-3-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
CID 62324258
N-propan-2-yl-2-(2-propan-2-ylphenoxy)acetamide
CID 19168088

Frequently Asked Questions

What is the IUPAC name of 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide?
The IUPAC name of 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide (CID 100829038) is 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide?
The canonical SMILES for 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide is CC(C)NC(=O)CCNC(=O)COc1cccc2c1NC(=O)CC2.
What is the InChIKey of 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide?
The InChIKey is QQYOZBQWZHRIPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O4/c1-11(2)19-15(22)8-9-18-16(23)10-24-13-5-3-4-12-6-7-14(21)20-17(12)13/h3-5,11H,6-10H2,1-2H3,(H,18,23)(H,19,22)(H,20,21).
What are the key properties of 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide?
3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide has a molecular weight of 333.39 g/mol, XLogP of 0.98, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-8-yl)oxy]acetyl]amino]-N-propan-2-ylpropanamide is sourced from PubChem (CID 100829038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).