ethyl 2-(cyclopropylmethylamino)acetate

C8H15NO2 — CID 22175907

IUPACethyl 2-(cyclopropylmethylamino)acetate
SMILESCCOC(=O)CNCC1CC1
InChIInChI=1S/C8H15NO2/c1-2-11-8(10)6-9-5-7-3-4-7/h7,9H,2-6H2,1H3
InChIKeyBFFAICONXNLADT-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.55
Rot. Bonds5

About ethyl 2-(cyclopropylmethylamino)acetate

ethyl 2-(cyclopropylmethylamino)acetate (PubChem CID 22175907) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is ethyl 2-(cyclopropylmethylamino)acetate.

Molecular Properties

Compound Nameethyl 2-(cyclopropylmethylamino)acetate
PubChem CID22175907
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Nameethyl 2-(cyclopropylmethylamino)acetate
SMILESCCOC(=O)CNCC1CC1
InChIInChI=1S/C8H15NO2/c1-2-11-8(10)6-9-5-7-3-4-7/h7,9H,2-6H2,1H3
InChIKeyBFFAICONXNLADT-UHFFFAOYSA-N
XLogP0.55
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethyl 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

Ethyl 2-(propylamino)acetate
CID 13454968
Glycine, N-cyclopropyl-, ethyl ester
CID 22476174
Ethyl 2-(pentylamino)acetate
CID 10035079
Ethyl 2-(isobutylamino)acetate
CID 10877410
Ethyl 2-(cyclopropylamino)propanoate
CID 20213381
Methyl 2-[(cyclopropylmethyl)amino]acetate
CID 28566992
Ethyl 2-(butylamino)acetate
CID 10607047
Methyl 2-[(2-methylpropyl)amino]acetate
CID 22175789
Ethyl 2-(cyclopropylmethylamino)-3,3,3-trifluoro-2-methylpropanoate
CID 106523355
Ethyl 2-(cyclopropanecarbonylamino)acetate
CID 5228151
2-Methylpropyl 2-(methylamino)acetate
CID 13743418
2-Methylpropyl 2-[[2-(2-methylpropoxy)-2-oxoethyl]amino]acetate
CID 13743430

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(cyclopropylmethylamino)acetate?
The IUPAC name of ethyl 2-(cyclopropylmethylamino)acetate (CID 22175907) is ethyl 2-(cyclopropylmethylamino)acetate.
What is the SMILES notation for ethyl 2-(cyclopropylmethylamino)acetate?
The canonical SMILES for ethyl 2-(cyclopropylmethylamino)acetate is CCOC(=O)CNCC1CC1.
What is the InChIKey of ethyl 2-(cyclopropylmethylamino)acetate?
The InChIKey is BFFAICONXNLADT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-2-11-8(10)6-9-5-7-3-4-7/h7,9H,2-6H2,1H3.
What are the key properties of ethyl 2-(cyclopropylmethylamino)acetate?
ethyl 2-(cyclopropylmethylamino)acetate has a molecular weight of 157.21 g/mol, XLogP of 0.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(cyclopropylmethylamino)acetate is sourced from PubChem (CID 22175907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).