methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate

C14H21NO2S — CID 62345405

IUPACmethyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate
SMILESCCc1ccc(C(NC2CCCC2)C(=O)OC)s1
InChIInChI=1S/C14H21NO2S/c1-3-11-8-9-12(18-11)13(14(16)17-2)15-10-6-4-5-7-10/h8-10,13,15H,3-7H2,1-2H3
InChIKeyNRDBXYLXCYODDO-UHFFFAOYSA-N
MW267.39 g/mol
LogP3.06
Rot. Bonds5

About methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate

methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate (PubChem CID 62345405) has the molecular formula C14H21NO2S and a molecular weight of 267.39 g/mol. Its IUPAC name is methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate.

Molecular Properties

Compound Namemethyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate
PubChem CID62345405
Molecular FormulaC14H21NO2S
Molecular Weight267.39 g/mol
Exact Mass267.13
IUPAC Namemethyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate
SMILESCCc1ccc(C(NC2CCCC2)C(=O)OC)s1
InChIInChI=1S/C14H21NO2S/c1-3-11-8-9-12(18-11)13(14(16)17-2)15-10-6-4-5-7-10/h8-10,13,15H,3-7H2,1-2H3
InChIKeyNRDBXYLXCYODDO-UHFFFAOYSA-N
XLogP3.06
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.39
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cycloheptylamino)-2-(5-ethylthiophen-2-yl)acetamide
CID 62345928
ethyl 2-(cyclohexylamino)-2-(5-methylthiophen-2-yl)acetate
CID 61345599
ethyl 2-(5-bromothiophen-2-yl)-2-(cycloheptylamino)acetate
CID 61346829
ethyl 2-(cyclopropylmethylamino)-2-(5-ethylthiophen-2-yl)acetate
CID 62345226
methyl 2-(4-bromo-5-chlorothiophen-2-yl)-2-(cycloheptylamino)acetate
CID 102840978
methyl 2-(5-ethylthiophen-2-yl)-2-piperazin-1-ylacetate
CID 62347366
methyl 2-(2-bromoanilino)-2-(5-ethylthiophen-2-yl)acetate
CID 62346114
methyl 2-(5-ethylthiophen-2-yl)-2-(2-fluoroanilino)acetate
CID 62347183
methyl 2-(cyclohexylamino)-2-phenylacetate
CID 3755192
(R)-cyclopentyl-(5-ethylthiophen-2-yl)methanamine;hydrochloride
CID 171211749
2-(cyclopentylamino)-2-(5-methylthiophen-2-yl)acetic acid
CID 61345197
methyl (3S)-3-amino-3-(5-ethylthiophen-2-yl)propanoate;hydrochloride
CID 171243576

Frequently Asked Questions

What is the IUPAC name of methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate?
The IUPAC name of methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate (CID 62345405) is methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate.
What is the SMILES notation for methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate?
The canonical SMILES for methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate is CCc1ccc(C(NC2CCCC2)C(=O)OC)s1.
What is the InChIKey of methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate?
The InChIKey is NRDBXYLXCYODDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2S/c1-3-11-8-9-12(18-11)13(14(16)17-2)15-10-6-4-5-7-10/h8-10,13,15H,3-7H2,1-2H3.
What are the key properties of methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate?
methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate has a molecular weight of 267.39 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(cyclopentylamino)-2-(5-ethylthiophen-2-yl)acetate is sourced from PubChem (CID 62345405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).