cyclopentylmethyl 2-(cyclopropylmethylamino)acetate

C12H21NO2 — CID 66323510

IUPACcyclopentylmethyl 2-(cyclopropylmethylamino)acetate
SMILESO=C(CNCC1CC1)OCC1CCCC1
InChIInChI=1S/C12H21NO2/c14-12(8-13-7-10-5-6-10)15-9-11-3-1-2-4-11/h10-11,13H,1-9H2
InChIKeyUQBHCQBZNRBHBF-UHFFFAOYSA-N
MW211.30 g/mol
LogP1.72
Rot. Bonds6

About cyclopentylmethyl 2-(cyclopropylmethylamino)acetate

cyclopentylmethyl 2-(cyclopropylmethylamino)acetate (PubChem CID 66323510) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is cyclopentylmethyl 2-(cyclopropylmethylamino)acetate.

Molecular Properties

Compound Namecyclopentylmethyl 2-(cyclopropylmethylamino)acetate
PubChem CID66323510
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Namecyclopentylmethyl 2-(cyclopropylmethylamino)acetate
SMILESO=C(CNCC1CC1)OCC1CCCC1
InChIInChI=1S/C12H21NO2/c14-12(8-13-7-10-5-6-10)15-9-11-3-1-2-4-11/h10-11,13H,1-9H2
InChIKeyUQBHCQBZNRBHBF-UHFFFAOYSA-N
XLogP1.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze cyclopentylmethyl 2-(cyclopropylmethylamino)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

cycloheptylmethyl 2-(cyclopropylmethylamino)acetate
CID 114248573
3-(cyclohexylmethoxy)-3-oxopropanoic acid
CID 19378623
1-cyclopentyl-3-(cyclopropylmethylamino)propan-2-one
CID 116557677
N-cyclopentyloxy-2-(cyclopropylmethylamino)acetamide
CID 83235393
ethyl 2-[(4-ethylcyclohexyl)methylamino]acetate
CID 55025429
cyclopropylmethyl 3-oxobutanoate
CID 10012135
cyclopropylmethyl 3-oxopropanoate
CID 174157836
2-(cyclopentylmethoxy)-2-oxoethanesulfonic acid
CID 129061918
cyclohexylmethyl 2-oxoacetate
CID 174782114
1-cycloheptyl-2-(cyclopropylmethylamino)ethanone
CID 116557770
cyclopentylmethyl 2-pyrrolidin-2-ylacetate
CID 66323077
cyclopentylmethyl 2-methoxyacetate;molecular hydrogen
CID 161365389

Frequently Asked Questions

What is the IUPAC name of cyclopentylmethyl 2-(cyclopropylmethylamino)acetate?
The IUPAC name of cyclopentylmethyl 2-(cyclopropylmethylamino)acetate (CID 66323510) is cyclopentylmethyl 2-(cyclopropylmethylamino)acetate.
What is the SMILES notation for cyclopentylmethyl 2-(cyclopropylmethylamino)acetate?
The canonical SMILES for cyclopentylmethyl 2-(cyclopropylmethylamino)acetate is O=C(CNCC1CC1)OCC1CCCC1.
What is the InChIKey of cyclopentylmethyl 2-(cyclopropylmethylamino)acetate?
The InChIKey is UQBHCQBZNRBHBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c14-12(8-13-7-10-5-6-10)15-9-11-3-1-2-4-11/h10-11,13H,1-9H2.
What are the key properties of cyclopentylmethyl 2-(cyclopropylmethylamino)acetate?
cyclopentylmethyl 2-(cyclopropylmethylamino)acetate has a molecular weight of 211.30 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentylmethyl 2-(cyclopropylmethylamino)acetate is sourced from PubChem (CID 66323510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).