ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate

C15H19Cl2NO2 — CID 60998051

IUPACethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate
SMILESCCOC(=O)C(NC1CCCC1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H19Cl2NO2/c1-2-20-15(19)14(18-13-5-3-4-6-13)10-7-11(16)9-12(17)8-10/h7-9,13-14,18H,2-6H2,1H3
InChIKeyFOLSOXIXGPBYRM-UHFFFAOYSA-N
MW316.23 g/mol
LogP4.13
Rot. Bonds5

About ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate

ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate (PubChem CID 60998051) has the molecular formula C15H19Cl2NO2 and a molecular weight of 316.23 g/mol. Its IUPAC name is ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate.

Molecular Properties

Compound Nameethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate
PubChem CID60998051
Molecular FormulaC15H19Cl2NO2
Molecular Weight316.23 g/mol
Exact Mass315.08
IUPAC Nameethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate
SMILESCCOC(=O)C(NC1CCCC1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H19Cl2NO2/c1-2-20-15(19)14(18-13-5-3-4-6-13)10-7-11(16)9-12(17)8-10/h7-9,13-14,18H,2-6H2,1H3
InChIKeyFOLSOXIXGPBYRM-UHFFFAOYSA-N
XLogP4.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.23
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-(3-chlorophenyl)-2-(cyclopentylamino)acetate
CID 54893052
ethyl 2-(cyclopentylamino)-2-(4-hydroxy-3,5-dimethylphenyl)acetate
CID 60998655
ethyl 2-(3-chloro-4-fluorophenyl)-2-(cyclopentylamino)acetate
CID 81146254
ethyl 2-(4-chloro-2-fluorophenyl)-2-(cyclohexylamino)acetate
CID 114843746
2-(cyclohexylamino)-2-(3,5-dichlorophenyl)acetic acid
CID 54893022
ethyl 2-(3,5-dichlorophenyl)-2-(methylamino)acetate
CID 60787061
ethyl 2-(3-chloro-4-fluorophenyl)-2-(cyclopropylamino)acetate
CID 81146015
ethyl 2-(cyclopentylamino)-2-(3-fluorophenyl)acetate
CID 54892911
ethyl 2-(cyclopropylamino)-2-(3,4,5-trifluorophenyl)acetate
CID 55147934
ethyl 2-(cyclopentylamino)-2-thiophen-3-ylacetate
CID 54892913
ethyl 2-(cyclohexylamino)-2-(6-methyl-3-pyridinyl)acetate
CID 104822573
ethyl 2-(cyclohexylamino)-2-(3-methoxyphenyl)acetate
CID 60998192

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate?
The IUPAC name of ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate (CID 60998051) is ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate.
What is the SMILES notation for ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate?
The canonical SMILES for ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate is CCOC(=O)C(NC1CCCC1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate?
The InChIKey is FOLSOXIXGPBYRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19Cl2NO2/c1-2-20-15(19)14(18-13-5-3-4-6-13)10-7-11(16)9-12(17)8-10/h7-9,13-14,18H,2-6H2,1H3.
What are the key properties of ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate?
ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate has a molecular weight of 316.23 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(cyclopentylamino)-2-(3,5-dichlorophenyl)acetate is sourced from PubChem (CID 60998051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).