2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide

C19H26N4O2 — CID 125141474

IUPAC2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
SMILESCc1cnc2c(C)cccc2c1N1CCO[C@H](CN(C)CC(N)=O)C1
InChIInChI=1S/C19H26N4O2/c1-13-5-4-6-16-18(13)21-9-14(2)19(16)23-7-8-25-15(11-23)10-22(3)12-17(20)24/h4-6,9,15H,7-8,10-12H2,1-3H3,(H2,20,24)/t15-/m1/s1
InChIKeyVJEIFQUAPNUMDG-OAHLLOKOSA-N
MW342.44 g/mol
LogP1.47
Rot. Bonds5

About 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide

2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide (PubChem CID 125141474) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide.

Molecular Properties

Compound Name2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
PubChem CID125141474
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
SMILESCc1cnc2c(C)cccc2c1N1CCO[C@H](CN(C)CC(N)=O)C1
InChIInChI=1S/C19H26N4O2/c1-13-5-4-6-16-18(13)21-9-14(2)19(16)23-7-8-25-15(11-23)10-22(3)12-17(20)24/h4-6,9,15H,7-8,10-12H2,1-3H3,(H2,20,24)/t15-/m1/s1
InChIKeyVJEIFQUAPNUMDG-OAHLLOKOSA-N
XLogP1.47
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Quinoline, 4-(4-morpholinyl)-2-(2-pyridinyl)-
CID 453059
N',N'-dimethyl-N-[2-[3-[(2-morpholin-4-ylethylamino)methyl]phenyl]quinolin-4-yl]propane-1,3-diamine
CID 44421942
N',N'-dimethyl-N-[[3-[4-(2-morpholin-4-ylethylamino)quinolin-2-yl]phenyl]methyl]propane-1,3-diamine
CID 44422000
(E)-N-(2-morpholin-4-ylphenyl)-3-quinolin-8-ylprop-2-enamide
CID 51333599
4-Morpholineacetamide, N-(1,2,3,4-tetrahydro-9-acridinyl)-
CID 3079929
2-(3-ethoxy-2-oxopyrido[3,4-b]pyrazin-1-yl)-N-(2-ethyl-6-methylphenyl)acetamide
CID 20955276
N'-[(2-chloro-8-methyl-3-quinolinyl)methylene]-2-(4-morpholinyl)acetohydrazide
CID 6897088
8-(Trifluoromethyl)-4-[2-(trifluoromethyl)morpholin-4-YL]quinoline
CID 56881153
2-morpholin-4-yl-N-[2-[[2-[(E)-2-phenylethenyl]quinolin-4-yl]amino]ethyl]acetamide
CID 155551123
US10071974, Example 11
CID 121346612
US10577336, Example 8
CID 121346616
Pyridinium, 1-(2-oxo-2-((1,2,3,4-tetrahydro-9-acridinyl)amino)ethyl)-, chloride
CID 3079932

Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide?
The IUPAC name of 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide (CID 125141474) is 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide.
What is the SMILES notation for 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide?
The canonical SMILES for 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide is Cc1cnc2c(C)cccc2c1N1CCO[C@H](CN(C)CC(N)=O)C1.
What is the InChIKey of 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide?
The InChIKey is VJEIFQUAPNUMDG-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-13-5-4-6-16-18(13)21-9-14(2)19(16)23-7-8-25-15(11-23)10-22(3)12-17(20)24/h4-6,9,15H,7-8,10-12H2,1-3H3,(H2,20,24)/t15-/m1/s1.
What are the key properties of 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide?
2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide has a molecular weight of 342.44 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide is sourced from PubChem (CID 125141474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).