N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide

C15H18Cl2N2O3 — CID 112990888

IUPACN-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)NCC(=O)NC1CCCC1
InChIInChI=1S/C15H18Cl2N2O3/c16-10-5-6-13(12(17)7-10)22-9-15(21)18-8-14(20)19-11-3-1-2-4-11/h5-7,11H,1-4,8-9H2,(H,18,21)(H,19,20)
InChIKeyDRSFVZIRDKDIOL-UHFFFAOYSA-N
MW345.23 g/mol
LogP2.55
Rot. Bonds6

About N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide

N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide (PubChem CID 112990888) has the molecular formula C15H18Cl2N2O3 and a molecular weight of 345.23 g/mol. Its IUPAC name is N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide
PubChem CID112990888
Molecular FormulaC15H18Cl2N2O3
Molecular Weight345.23 g/mol
Exact Mass344.07
IUPAC NameN-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)NCC(=O)NC1CCCC1
InChIInChI=1S/C15H18Cl2N2O3/c16-10-5-6-13(12(17)7-10)22-9-15(21)18-8-14(20)19-11-3-1-2-4-11/h5-7,11H,1-4,8-9H2,(H,18,21)(H,19,20)
InChIKeyDRSFVZIRDKDIOL-UHFFFAOYSA-N
XLogP2.55
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.23
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide (CID 112990888) is N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide is O=C(COc1ccc(Cl)cc1Cl)NCC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide?
The InChIKey is DRSFVZIRDKDIOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18Cl2N2O3/c16-10-5-6-13(12(17)7-10)22-9-15(21)18-8-14(20)19-11-3-1-2-4-11/h5-7,11H,1-4,8-9H2,(H,18,21)(H,19,20).
What are the key properties of N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide?
N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide has a molecular weight of 345.23 g/mol, XLogP of 2.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide is sourced from PubChem (CID 112990888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).