ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate

C10H17NO5 — CID 79345308

IUPACethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate
SMILESCCOC(=O)CN(C(=O)OCCO)C1CC1
InChIInChI=1S/C10H17NO5/c1-2-15-9(13)7-11(8-3-4-8)10(14)16-6-5-12/h8,12H,2-7H2,1H3
InChIKeyDNMDEOGPWMADQR-UHFFFAOYSA-N
MW231.25 g/mol
LogP0.14
Rot. Bonds6

About ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate

ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate (PubChem CID 79345308) has the molecular formula C10H17NO5 and a molecular weight of 231.25 g/mol. Its IUPAC name is ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate
PubChem CID79345308
Molecular FormulaC10H17NO5
Molecular Weight231.25 g/mol
Exact Mass231.11
IUPAC Nameethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate
SMILESCCOC(=O)CN(C(=O)OCCO)C1CC1
InChIInChI=1S/C10H17NO5/c1-2-15-9(13)7-11(8-3-4-8)10(14)16-6-5-12/h8,12H,2-7H2,1H3
InChIKeyDNMDEOGPWMADQR-UHFFFAOYSA-N
XLogP0.14
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-[cyclopropyl(2,2,2-trifluoroethoxycarbonyl)amino]acetate
CID 65173932
2-hydroxyethyl N-cyclopropyl-N-propylcarbamate
CID 79346146
ethyl 2-[cyclopropyl(5-hydroxypentanoyl)amino]acetate
CID 79199605
ethyl 2-[cyclopropyl-(2-cyclopropylacetyl)amino]acetate
CID 55150352
ethyl 2-[cyclopropyl-(2-methoxyacetyl)amino]acetate
CID 61410290
ethyl 2-[(1-aminocyclopropanecarbonyl)-cyclopropylamino]acetate
CID 65465117
ethyl 2-[[(2S)-2-aminopropanoyl]-cyclopropylamino]acetate
CID 61148316
ethyl 2-[3-chloropropanoyl(cyclopropyl)amino]acetate
CID 60949097
ethyl 2-[cyclobutanecarbonyl(cyclopropyl)amino]acetate
CID 55150350
ethyl 2-[cyclopropyl(phenoxycarbonyl)amino]acetate
CID 54979510
ethyl 2-[(2-aminoacetyl)-cyclobutylamino]acetate
CID 69042060
ethyl 2-[cyclopropyl(cyclopropylcarbamoyl)amino]acetate
CID 62698175

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate?
The IUPAC name of ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate (CID 79345308) is ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate.
What is the SMILES notation for ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate?
The canonical SMILES for ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate is CCOC(=O)CN(C(=O)OCCO)C1CC1.
What is the InChIKey of ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate?
The InChIKey is DNMDEOGPWMADQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO5/c1-2-15-9(13)7-11(8-3-4-8)10(14)16-6-5-12/h8,12H,2-7H2,1H3.
What are the key properties of ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate?
ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate has a molecular weight of 231.25 g/mol, XLogP of 0.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[cyclopropyl(2-hydroxyethoxycarbonyl)amino]acetate is sourced from PubChem (CID 79345308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).