2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide

C20H23Cl2N3O3 — CID 55795684

IUPAC2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide
SMILESCC1CN(c2ccc(NC(=O)C(C)Oc3ccc(Cl)c(Cl)c3)cn2)CC(C)O1
InChIInChI=1S/C20H23Cl2N3O3/c1-12-10-25(11-13(2)27-12)19-7-4-15(9-23-19)24-20(26)14(3)28-16-5-6-17(21)18(22)8-16/h4-9,12-14H,10-11H2,1-3H3,(H,24,26)
InChIKeyUMZJYQDEHWCZLK-UHFFFAOYSA-N
MW424.33 g/mol
LogP4.41
Rot. Bonds5

About 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide

2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide (PubChem CID 55795684) has the molecular formula C20H23Cl2N3O3 and a molecular weight of 424.33 g/mol. Its IUPAC name is 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide
PubChem CID55795684
Molecular FormulaC20H23Cl2N3O3
Molecular Weight424.33 g/mol
Exact Mass423.11
IUPAC Name2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide
SMILESCC1CN(c2ccc(NC(=O)C(C)Oc3ccc(Cl)c(Cl)c3)cn2)CC(C)O1
InChIInChI=1S/C20H23Cl2N3O3/c1-12-10-25(11-13(2)27-12)19-7-4-15(9-23-19)24-20(26)14(3)28-16-5-6-17(21)18(22)8-16/h4-9,12-14H,10-11H2,1-3H3,(H,24,26)
InChIKeyUMZJYQDEHWCZLK-UHFFFAOYSA-N
XLogP4.41
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.33
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide with MolForge

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Related Compounds

2-(4-chloro-3-methylphenoxy)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 55823804
2-(4-chlorophenoxy)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide
CID 17459411
2-(2,4-dichlorophenyl)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]acetamide
CID 55786440
2-(4-methylphenoxy)-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 43041620
2-(4-bromophenoxy)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 24590426
(2S)-N-(4-bromophenyl)-2-(3,4-dichlorophenoxy)propanamide
CID 7751387
N-[1-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]amino]-3-methyl-1-oxopentan-2-yl]benzamide
CID 55786036
N-[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]pyrazine-2-carboxamide
CID 95149576
(2R)-N-(3,4-dichlorophenyl)-2-(4-fluorophenoxy)propanamide
CID 40721189
(2S)-2-(4-tert-butylphenoxy)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide
CID 25396972
2-(4-chloro-3-methylphenoxy)-N-(3,4-dichlorophenyl)propanamide
CID 53265973
N-cyclooctyl-N'-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]oxamide
CID 71889123

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide?
The IUPAC name of 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide (CID 55795684) is 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide.
What is the SMILES notation for 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide?
The canonical SMILES for 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide is CC1CN(c2ccc(NC(=O)C(C)Oc3ccc(Cl)c(Cl)c3)cn2)CC(C)O1.
What is the InChIKey of 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide?
The InChIKey is UMZJYQDEHWCZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23Cl2N3O3/c1-12-10-25(11-13(2)27-12)19-7-4-15(9-23-19)24-20(26)14(3)28-16-5-6-17(21)18(22)8-16/h4-9,12-14H,10-11H2,1-3H3,(H,24,26).
What are the key properties of 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide?
2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide has a molecular weight of 424.33 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenoxy)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]propanamide is sourced from PubChem (CID 55795684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).