ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate

C15H20N2O3 — CID 110485909

IUPACethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate
SMILESCCOC(=O)CNC(=O)c1ccc2c(c1)CCCN2C
InChIInChI=1S/C15H20N2O3/c1-3-20-14(18)10-16-15(19)12-6-7-13-11(9-12)5-4-8-17(13)2/h6-7,9H,3-5,8,10H2,1-2H3,(H,16,19)
InChIKeyUVEFOUAXZSTVKN-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.36
Rot. Bonds4

About ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate

ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate (PubChem CID 110485909) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate
PubChem CID110485909
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Nameethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate
SMILESCCOC(=O)CNC(=O)c1ccc2c(c1)CCCN2C
InChIInChI=1S/C15H20N2O3/c1-3-20-14(18)10-16-15(19)12-6-7-13-11(9-12)5-4-8-17(13)2/h6-7,9H,3-5,8,10H2,1-2H3,(H,16,19)
InChIKeyUVEFOUAXZSTVKN-UHFFFAOYSA-N
XLogP1.36
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]propanoate
CID 110485913
N-[2-(2-hydroxyethoxy)ethyl]-1-methyl-3,4-dihydro-2H-quinoline-6-carboxamide
CID 110485923
N-(3-formamidopropyl)-1-methyl-3,4-dihydro-2H-quinoline-6-carboxamide
CID 110485916
1-methyl-N-propan-2-yl-2,3,4,5-tetrahydro-1-benzazepine-7-carboxamide
CID 58575703
ethyl 2-[(3-amino-4-methylbenzoyl)amino]acetate
CID 60810629
ethyl 2-(naphthalene-2-carbonylamino)acetate
CID 43007593
fluoro 1-methyl-3,4-dihydro-2H-quinoline-6-carboxylate
CID 142338422
N-butyl-1-methyl-2,3-dihydroindole-5-carboxamide
CID 110485487
ethyl 2-[(3,4-dichlorobenzoyl)amino]acetate
CID 5039478
ethyl 2-[[4-oxo-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoyl]amino]acetate
CID 108807177
4-ethoxy-N-[(2S)-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]benzamide
CID 30577403
ethyl 2-[[4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3,5-triazin-2-yl]amino]acetate
CID 23536179

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate?
The IUPAC name of ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate (CID 110485909) is ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate.
What is the SMILES notation for ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate?
The canonical SMILES for ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate is CCOC(=O)CNC(=O)c1ccc2c(c1)CCCN2C.
What is the InChIKey of ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate?
The InChIKey is UVEFOUAXZSTVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-3-20-14(18)10-16-15(19)12-6-7-13-11(9-12)5-4-8-17(13)2/h6-7,9H,3-5,8,10H2,1-2H3,(H,16,19).
What are the key properties of ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate?
ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate has a molecular weight of 276.34 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[(1-methyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]acetate is sourced from PubChem (CID 110485909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).