ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate

C14H27NO2 — CID 64921594

IUPACethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate
SMILESCCOC(=O)C(C)CNC1CCC(CC)C1C
InChIInChI=1S/C14H27NO2/c1-5-12-7-8-13(11(12)4)15-9-10(3)14(16)17-6-2/h10-13,15H,5-9H2,1-4H3
InChIKeyCUCAEFSHLPFRLI-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.60
Rot. Bonds6

About ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate

ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate (PubChem CID 64921594) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate.

Molecular Properties

Compound Nameethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate
PubChem CID64921594
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Nameethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate
SMILESCCOC(=O)C(C)CNC1CCC(CC)C1C
InChIInChI=1S/C14H27NO2/c1-5-12-7-8-13(11(12)4)15-9-10(3)14(16)17-6-2/h10-13,15H,5-9H2,1-4H3
InChIKeyCUCAEFSHLPFRLI-UHFFFAOYSA-N
XLogP2.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanamide
CID 64921181
ethyl 3-[(2,4-dimethylcyclohexyl)amino]-2-methylpropanoate
CID 63995099
ethyl 3-(cyclobutylamino)-2-methylpropanoate
CID 62415345
methyl 2-[(3-ethyl-2-methylcyclopentyl)amino]acetate
CID 64920601
methyl 2-[(3-ethyl-2-methylcyclopentyl)amino]hexanoate
CID 103254067
propan-2-yl N-(3-ethyl-2-methylcyclopentyl)carbamate
CID 116656380
2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide
CID 64921195
acetic acid;ethyl 3-(cyclohexylamino)-2-methylpropanoate
CID 68737349
ethyl 2-[(3-ethyl-2-methylcyclopentyl)carbamoylamino]acetate
CID 64916038
ethyl 2-methyl-3-[(2,2,3,3-tetramethylcyclopropyl)amino]propanoate
CID 79357961
N-(3-ethyl-2-methylcyclopentyl)-2-sulfanylpropanamide
CID 107031086
methyl 2-cyclopropyl-2-[(3-ethyl-2-methylcyclopentyl)amino]acetate
CID 103254073

Frequently Asked Questions

What is the IUPAC name of ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate?
The IUPAC name of ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate (CID 64921594) is ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate.
What is the SMILES notation for ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate?
The canonical SMILES for ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate is CCOC(=O)C(C)CNC1CCC(CC)C1C.
What is the InChIKey of ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate?
The InChIKey is CUCAEFSHLPFRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-5-12-7-8-13(11(12)4)15-9-10(3)14(16)17-6-2/h10-13,15H,5-9H2,1-4H3.
What are the key properties of ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate?
ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate has a molecular weight of 241.37 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate is sourced from PubChem (CID 64921594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).