2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide

C16H16Cl2N4O3 — CID 90544150

IUPAC2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1cc(N2CCOCC2)ncn1
InChIInChI=1S/C16H16Cl2N4O3/c17-11-1-2-13(12(18)7-11)25-9-16(23)21-14-8-15(20-10-19-14)22-3-5-24-6-4-22/h1-2,7-8,10H,3-6,9H2,(H,19,20,21,23)
InChIKeyBGKLTXITJODECT-UHFFFAOYSA-N
MW383.24 g/mol
LogP2.64
Rot. Bonds5

About 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide

2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide (PubChem CID 90544150) has the molecular formula C16H16Cl2N4O3 and a molecular weight of 383.24 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
PubChem CID90544150
Molecular FormulaC16H16Cl2N4O3
Molecular Weight383.24 g/mol
Exact Mass382.06
IUPAC Name2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1cc(N2CCOCC2)ncn1
InChIInChI=1S/C16H16Cl2N4O3/c17-11-1-2-13(12(18)7-11)25-9-16(23)21-14-8-15(20-10-19-14)22-3-5-24-6-4-22/h1-2,7-8,10H,3-6,9H2,(H,19,20,21,23)
InChIKeyBGKLTXITJODECT-UHFFFAOYSA-N
XLogP2.64
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.24
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2,4-dichlorophenoxy)-N-(6-piperidin-1-ylpyrimidin-4-yl)acetamide
CID 90544493
2-(2-chlorophenyl)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
CID 71794834
2-(3-methylphenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
CID 90544202
2-(2,4-dichlorophenoxy)-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 979211
2-(2,5-dichlorophenoxy)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 34444546
2-chloro-N-(6-morpholin-4-ylpyrimidin-4-yl)benzamide
CID 90544108
2-(2,4-dichlorophenoxy)-1-[4-[6-[(4-methyl-2-pyridinyl)amino]pyrimidin-4-yl]piperazin-1-yl]ethanone
CID 122349361
3,5-dichloro-N-(6-morpholin-4-ylpyrimidin-4-yl)benzamide
CID 90544249
2-(2,4-dichlorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 1080666
2-(2,4-dichlorophenoxy)-N'-(6-morpholin-4-yl-5-nitropyrimidin-4-yl)acetohydrazide
CID 23489626
2-(2,4-dichlorophenoxy)-N-[3-(4-morpholin-4-ylphenyl)propyl]acetamide
CID 16890044
2-(2,4-dichlorophenoxy)-N-[2-(morpholin-4-ylmethyl)phenyl]acetamide
CID 55899065

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide (CID 90544150) is 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide is O=C(COc1ccc(Cl)cc1Cl)Nc1cc(N2CCOCC2)ncn1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide?
The InChIKey is BGKLTXITJODECT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N4O3/c17-11-1-2-13(12(18)7-11)25-9-16(23)21-14-8-15(20-10-19-14)22-3-5-24-6-4-22/h1-2,7-8,10H,3-6,9H2,(H,19,20,21,23).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide?
2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide has a molecular weight of 383.24 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide is sourced from PubChem (CID 90544150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).