2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide

C20H27N3O3 — CID 128977543

IUPAC2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide
SMILESCN(C)C(=O)COCC1CN(c2ccc3ccccc3n2)CC(C)(C)O1
InChIInChI=1S/C20H27N3O3/c1-20(2)14-23(11-16(26-20)12-25-13-19(24)22(3)4)18-10-9-15-7-5-6-8-17(15)21-18/h5-10,16H,11-14H2,1-4H3
InChIKeyJLBVRXDDXXHUQS-UHFFFAOYSA-N
MW357.45 g/mol
LogP2.32
Rot. Bonds5

About 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide

2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide (PubChem CID 128977543) has the molecular formula C20H27N3O3 and a molecular weight of 357.45 g/mol. Its IUPAC name is 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide
PubChem CID128977543
Molecular FormulaC20H27N3O3
Molecular Weight357.45 g/mol
Exact Mass357.21
IUPAC Name2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide
SMILESCN(C)C(=O)COCC1CN(c2ccc3ccccc3n2)CC(C)(C)O1
InChIInChI=1S/C20H27N3O3/c1-20(2)14-23(11-16(26-20)12-25-13-19(24)22(3)4)18-10-9-15-7-5-6-8-17(15)21-18/h5-10,16H,11-14H2,1-4H3
InChIKeyJLBVRXDDXXHUQS-UHFFFAOYSA-N
XLogP2.32
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methanamine
CID 114782247
2-[[(2R)-4-(3-chloro-2-pyridinyl)-6,6-dimethylmorpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 129484491
2-[[4-(5-fluoropyrimidin-2-yl)-6,6-dimethylmorpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 128977522
2-[[4-[(2-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 167981380
5-chloro-6-[6-[[2-(dimethylamino)-2-oxoethoxy]methyl]-2,2-dimethylmorpholin-4-yl]pyridine-3-carboxylic acid
CID 136549311
2-[[(2S)-6,6-dimethyl-4-[(1-methylpyrrol-2-yl)methyl]morpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 129482410
2-[[(2S)-6,6-dimethyl-4-[(3-methylphenyl)methyl]morpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 129483580
2-[[6,6-dimethyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 154739970
2-[[(2R)-4-[(3-fluorophenyl)methyl]-6,6-dimethylmorpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 129482251
2-[[4-[(3,5-difluorophenyl)methyl]-6,6-dimethylmorpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 128975967
2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 122132664
2-[[(2S)-6,6-dimethyl-4-[(5-methyl-1,2-oxazol-4-yl)methyl]morpholin-2-yl]methoxy]-N,N-dimethylacetamide
CID 129350879

Frequently Asked Questions

What is the IUPAC name of 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide?
The IUPAC name of 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide (CID 128977543) is 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide is CN(C)C(=O)COCC1CN(c2ccc3ccccc3n2)CC(C)(C)O1.
What is the InChIKey of 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide?
The InChIKey is JLBVRXDDXXHUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3/c1-20(2)14-23(11-16(26-20)12-25-13-19(24)22(3)4)18-10-9-15-7-5-6-8-17(15)21-18/h5-10,16H,11-14H2,1-4H3.
What are the key properties of 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide?
2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide has a molecular weight of 357.45 g/mol, XLogP of 2.32, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methoxy]-N,N-dimethylacetamide is sourced from PubChem (CID 128977543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).