ethyl 2-cyclopropyl-2-(ethylamino)propanoate

C10H19NO2 — CID 60788384

IUPACethyl 2-cyclopropyl-2-(ethylamino)propanoate
SMILESCCNC(C)(C(=O)OCC)C1CC1
InChIInChI=1S/C10H19NO2/c1-4-11-10(3,8-6-7-8)9(12)13-5-2/h8,11H,4-7H2,1-3H3
InChIKeyCINNBYOPXQGSPL-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.33
Rot. Bonds5

About ethyl 2-cyclopropyl-2-(ethylamino)propanoate

ethyl 2-cyclopropyl-2-(ethylamino)propanoate (PubChem CID 60788384) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is ethyl 2-cyclopropyl-2-(ethylamino)propanoate.

Molecular Properties

Compound Nameethyl 2-cyclopropyl-2-(ethylamino)propanoate
PubChem CID60788384
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Nameethyl 2-cyclopropyl-2-(ethylamino)propanoate
SMILESCCNC(C)(C(=O)OCC)C1CC1
InChIInChI=1S/C10H19NO2/c1-4-11-10(3,8-6-7-8)9(12)13-5-2/h8,11H,4-7H2,1-3H3
InChIKeyCINNBYOPXQGSPL-UHFFFAOYSA-N
XLogP1.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-cyclopropyl-2-(methylamino)propanoate
CID 60788390
ethyl 2-cyclohexyl-2-(prop-2-ynylamino)propanoate
CID 63323924
ethyl 2-cyclopropyl-2-(ethylamino)-3-[(2-methylpropan-2-yl)oxy]propanoate
CID 63921714
ethyl 2-(4-bromoanilino)-2-cyclopropylpropanoate
CID 54890637
ethyl 2-cyclopropyl-3-(3,3-dimethylbutoxy)-2-(ethylamino)propanoate
CID 66226799
ethyl 2-cyclopropyl-3-[2,2-dimethylpropyl(methyl)amino]-2-(propylamino)propanoate
CID 63911759
ethyl 2-cyclopropyl-2-(ethylamino)-2-phenylacetate
CID 114989601
ethyl 2-cyclopropyl-3-[2,2-dimethylpropyl(methyl)amino]-2-(methylamino)propanoate
CID 63909006
methyl 2-cyclopropyl-2-(cyclopropylmethylamino)propanoate
CID 61001123
ethyl 3-cyclohexyl-3-(ethylamino)butanoate
CID 65234163
ethyl 3-cyclohexylsulfanyl-2-cyclopropyl-2-(ethylamino)propanoate
CID 63920437
ethyl 2-cyclopropyl-2-(ethylamino)-3-(4-ethylpiperazin-1-yl)propanoate
CID 63905558

Frequently Asked Questions

What is the IUPAC name of ethyl 2-cyclopropyl-2-(ethylamino)propanoate?
The IUPAC name of ethyl 2-cyclopropyl-2-(ethylamino)propanoate (CID 60788384) is ethyl 2-cyclopropyl-2-(ethylamino)propanoate.
What is the SMILES notation for ethyl 2-cyclopropyl-2-(ethylamino)propanoate?
The canonical SMILES for ethyl 2-cyclopropyl-2-(ethylamino)propanoate is CCNC(C)(C(=O)OCC)C1CC1.
What is the InChIKey of ethyl 2-cyclopropyl-2-(ethylamino)propanoate?
The InChIKey is CINNBYOPXQGSPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-4-11-10(3,8-6-7-8)9(12)13-5-2/h8,11H,4-7H2,1-3H3.
What are the key properties of ethyl 2-cyclopropyl-2-(ethylamino)propanoate?
ethyl 2-cyclopropyl-2-(ethylamino)propanoate has a molecular weight of 185.27 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-cyclopropyl-2-(ethylamino)propanoate is sourced from PubChem (CID 60788384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).