N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide

C22H26N4O4 — CID 167803380

IUPACN-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide
SMILESCCCN1C(=O)CCc2cc(NC(=O)Nc3cccc(OCC(=O)NC)c3)ccc21
InChIInChI=1S/C22H26N4O4/c1-3-11-26-19-9-8-17(12-15(19)7-10-21(26)28)25-22(29)24-16-5-4-6-18(13-16)30-14-20(27)23-2/h4-6,8-9,12-13H,3,7,10-11,14H2,1-2H3,(H,23,27)(H2,24,25,29)
InChIKeyMTQXTAOZZXRHEF-UHFFFAOYSA-N
MW410.47 g/mol
LogP3.14
Rot. Bonds7

About N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide

N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide (PubChem CID 167803380) has the molecular formula C22H26N4O4 and a molecular weight of 410.47 g/mol. Its IUPAC name is N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide.

Molecular Properties

Compound NameN-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide
PubChem CID167803380
Molecular FormulaC22H26N4O4
Molecular Weight410.47 g/mol
Exact Mass410.20
IUPAC NameN-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide
SMILESCCCN1C(=O)CCc2cc(NC(=O)Nc3cccc(OCC(=O)NC)c3)ccc21
InChIInChI=1S/C22H26N4O4/c1-3-11-26-19-9-8-17(12-15(19)7-10-21(26)28)25-22(29)24-16-5-4-6-18(13-16)30-14-20(27)23-2/h4-6,8-9,12-13H,3,7,10-11,14H2,1-2H3,(H,23,27)(H2,24,25,29)
InChIKeyMTQXTAOZZXRHEF-UHFFFAOYSA-N
XLogP3.14
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.47
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide with MolForge

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Related Compounds

2,6-dimethoxy-N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)benzamide
CID 16926742
3,3-dimethyl-N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)butanamide
CID 16926796
2-(3-fluorophenoxy)-N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]acetamide
CID 16927276
N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)-2-phenoxybenzamide
CID 16926746
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-naphthalen-2-yloxyacetamide
CID 40946919
N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)-2-(2,3,5-trimethylphenoxy)acetamide
CID 16926831
1-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-(3-methylphenyl)urea
CID 30376245
2,2-dimethyl-N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)propanamide
CID 16926756
N-[1-(2-methylpropyl)-2-oxo-3,4-dihydroquinolin-6-yl]-2-phenoxyacetamide
CID 16828121
(2S)-2-methoxy-N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)propanamide
CID 97109094
1-(3-ethoxypropyl)-3-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)urea
CID 91911275
1-(1-butyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-(4-chlorophenyl)urea
CID 30376690

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide?
The IUPAC name of N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide (CID 167803380) is N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide.
What is the SMILES notation for N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide?
The canonical SMILES for N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide is CCCN1C(=O)CCc2cc(NC(=O)Nc3cccc(OCC(=O)NC)c3)ccc21.
What is the InChIKey of N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide?
The InChIKey is MTQXTAOZZXRHEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O4/c1-3-11-26-19-9-8-17(12-15(19)7-10-21(26)28)25-22(29)24-16-5-4-6-18(13-16)30-14-20(27)23-2/h4-6,8-9,12-13H,3,7,10-11,14H2,1-2H3,(H,23,27)(H2,24,25,29).
What are the key properties of N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide?
N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide has a molecular weight of 410.47 g/mol, XLogP of 3.14, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[3-[(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)carbamoylamino]phenoxy]acetamide is sourced from PubChem (CID 167803380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).