methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate

C15H18N2O3 — CID 107314668

IUPACmethyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate
SMILESCNC(C)(COc1ccc2cccnc2c1)C(=O)OC
InChIInChI=1S/C15H18N2O3/c1-15(16-2,14(18)19-3)10-20-12-7-6-11-5-4-8-17-13(11)9-12/h4-9,16H,10H2,1-3H3
InChIKeyCJPYPNCWAADIPM-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.76
Rot. Bonds5

About methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate

methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate (PubChem CID 107314668) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate.

Molecular Properties

Compound Namemethyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate
PubChem CID107314668
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Namemethyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate
SMILESCNC(C)(COc1ccc2cccnc2c1)C(=O)OC
InChIInChI=1S/C15H18N2O3/c1-15(16-2,14(18)19-3)10-20-12-7-6-11-5-4-8-17-13(11)9-12/h4-9,16H,10H2,1-3H3
InChIKeyCJPYPNCWAADIPM-UHFFFAOYSA-N
XLogP1.76
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-amino-2-methyl-3-quinolin-7-yloxypropan-2-ol
CID 107315662
quinolin-7-yl N,N-diethylcarbamate
CID 11334036
2-(methylamino)-3-quinolin-7-yloxypropanoic acid
CID 107314757
2-(ethylamino)-2-methyl-4-quinolin-7-yloxybutanamide
CID 107314784
methyl 3-[4-(2-hydroxyethyl)phenoxy]-2-methyl-2-(methylamino)propanoate
CID 107709939
2-quinolin-7-yloxyacetohydrazide
CID 107315402
quinolin-7-yl N,N-dimethylcarbamate
CID 11218314
2-amino-2-cyclopropyl-3-quinolin-7-yloxypropanoic acid
CID 107314695
N-methyl-2-quinolin-7-yloxypropan-1-amine
CID 107313762
2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine
CID 107314978
4-tert-butyl-N-(4-quinolin-7-yloxybut-2-ynyl)benzamide
CID 90580086
3-quinolin-7-yloxypropanal
CID 107314214

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate?
The IUPAC name of methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate (CID 107314668) is methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate.
What is the SMILES notation for methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate?
The canonical SMILES for methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate is CNC(C)(COc1ccc2cccnc2c1)C(=O)OC.
What is the InChIKey of methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate?
The InChIKey is CJPYPNCWAADIPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-15(16-2,14(18)19-3)10-20-12-7-6-11-5-4-8-17-13(11)9-12/h4-9,16H,10H2,1-3H3.
What are the key properties of methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate?
methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate has a molecular weight of 274.32 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-2-(methylamino)-3-quinolin-7-yloxypropanoate is sourced from PubChem (CID 107314668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).