2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide

C15H13Cl2N3O2 — CID 16953492

IUPAC2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1ncnc2c1CCC2
InChIInChI=1S/C15H13Cl2N3O2/c16-9-4-5-13(11(17)6-9)22-7-14(21)20-15-10-2-1-3-12(10)18-8-19-15/h4-6,8H,1-3,7H2,(H,18,19,20,21)
InChIKeyGFUCBYKAOVIDOA-UHFFFAOYSA-N
MW338.19 g/mol
LogP3.29
Rot. Bonds4

About 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide

2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide (PubChem CID 16953492) has the molecular formula C15H13Cl2N3O2 and a molecular weight of 338.19 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide
PubChem CID16953492
Molecular FormulaC15H13Cl2N3O2
Molecular Weight338.19 g/mol
Exact Mass337.04
IUPAC Name2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1ncnc2c1CCC2
InChIInChI=1S/C15H13Cl2N3O2/c16-9-4-5-13(11(17)6-9)22-7-14(21)20-15-10-2-1-3-12(10)18-8-19-15/h4-6,8H,1-3,7H2,(H,18,19,20,21)
InChIKeyGFUCBYKAOVIDOA-UHFFFAOYSA-N
XLogP3.29
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.19
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dichlorophenoxy)-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)acetamide
CID 16942316
N-(9-chloro-5,6,7,8-tetrahydroacridin-2-yl)-2-(2,4-dichlorophenoxy)acetamide
CID 5130019
N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320
2-(2,4-dichlorophenoxy)-N-quinolin-8-ylacetamide
CID 2180532
2-(2,4-dichlorophenoxy)-N-(6-piperidin-1-ylpyrimidin-4-yl)acetamide
CID 90544493
2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
CID 2198238
4-(4-chlorophenyl)sulfonyl-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)butanamide
CID 16953579
2-(2,4-dichlorophenoxy)-N-[4-[4-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-methylphenyl]-2-methylphenyl]acetamide
CID 2827268
2-(2,4-dichlorophenoxy)-N-pyridin-2-ylacetamide
CID 792334
N-[2-(2,4-dichlorophenyl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 63536590
N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-2-(2,4-dichlorophenoxy)acetamide
CID 110190112
2-(2,4-dichlorophenoxy)-N-(4-hydroxyphenyl)acetamide
CID 976414

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide (CID 16953492) is 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide is O=C(COc1ccc(Cl)cc1Cl)Nc1ncnc2c1CCC2.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide?
The InChIKey is GFUCBYKAOVIDOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2N3O2/c16-9-4-5-13(11(17)6-9)22-7-14(21)20-15-10-2-1-3-12(10)18-8-19-15/h4-6,8H,1-3,7H2,(H,18,19,20,21).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide?
2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide has a molecular weight of 338.19 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)acetamide is sourced from PubChem (CID 16953492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).