ethyl 2-(cyclopropanecarbonylamino)acetate

C8H13NO3 — CID 5228151

IUPACethyl 2-(cyclopropanecarbonylamino)acetate
SMILESCCOC(=O)CNC(=O)C1CC1
InChIInChI=1S/C8H13NO3/c1-2-12-7(10)5-9-8(11)6-3-4-6/h6H,2-5H2,1H3,(H,9,11)
InChIKeyVUIISTITQRZOHU-UHFFFAOYSA-N
MW171.20 g/mol
LogP0.08
Rot. Bonds4

About ethyl 2-(cyclopropanecarbonylamino)acetate

ethyl 2-(cyclopropanecarbonylamino)acetate (PubChem CID 5228151) has the molecular formula C8H13NO3 and a molecular weight of 171.20 g/mol. Its IUPAC name is ethyl 2-(cyclopropanecarbonylamino)acetate.

Molecular Properties

Compound Nameethyl 2-(cyclopropanecarbonylamino)acetate
PubChem CID5228151
Molecular FormulaC8H13NO3
Molecular Weight171.20 g/mol
Exact Mass171.09
IUPAC Nameethyl 2-(cyclopropanecarbonylamino)acetate
SMILESCCOC(=O)CNC(=O)C1CC1
InChIInChI=1S/C8H13NO3/c1-2-12-7(10)5-9-8(11)6-3-4-6/h6H,2-5H2,1H3,(H,9,11)
InChIKeyVUIISTITQRZOHU-UHFFFAOYSA-N
XLogP0.08
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-ethoxy-2-oxoethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 4193724
methyl 2-[[4-(aminomethyl)cyclohexanecarbonyl]amino]acetate
CID 79527105
ethyl (2R)-2-[[2-(cyclopropanecarbonylamino)acetyl]amino]propanoate
CID 94200698
ethyl 2-[[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-4-carbonyl]amino]acetate
CID 133394837
(2-ethoxy-2-oxoethyl)carbamic acid
CID 18800943
ethyl 2-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]acetate
CID 60817082
ethyl 2-(carbamoyl(15N)amino)acetate
CID 46781708
ethyl N-(cyclopropanecarbonyl)carbamate
CID 45084465
ethyl 2-(dithiepane-3-carbonylamino)acetate
CID 139826251
ethyl 2-(piperazine-2-carbonylamino)acetate
CID 54250774
ethyl 2-(1,3-thiazolidine-2-carbonylamino)acetate
CID 70296848
benzyl 2-(cyclopropanecarbonylamino)acetate
CID 26878245

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(cyclopropanecarbonylamino)acetate?
The IUPAC name of ethyl 2-(cyclopropanecarbonylamino)acetate (CID 5228151) is ethyl 2-(cyclopropanecarbonylamino)acetate.
What is the SMILES notation for ethyl 2-(cyclopropanecarbonylamino)acetate?
The canonical SMILES for ethyl 2-(cyclopropanecarbonylamino)acetate is CCOC(=O)CNC(=O)C1CC1.
What is the InChIKey of ethyl 2-(cyclopropanecarbonylamino)acetate?
The InChIKey is VUIISTITQRZOHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO3/c1-2-12-7(10)5-9-8(11)6-3-4-6/h6H,2-5H2,1H3,(H,9,11).
What are the key properties of ethyl 2-(cyclopropanecarbonylamino)acetate?
ethyl 2-(cyclopropanecarbonylamino)acetate has a molecular weight of 171.20 g/mol, XLogP of 0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(cyclopropanecarbonylamino)acetate is sourced from PubChem (CID 5228151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).