ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate

C10H19NO2 — CID 60777245

IUPACethyl 2-[cyclopropyl(propan-2-yl)amino]acetate
SMILESCCOC(=O)CN(C(C)C)C1CC1
InChIInChI=1S/C10H19NO2/c1-4-13-10(12)7-11(8(2)3)9-5-6-9/h8-9H,4-7H2,1-3H3
InChIKeyWIXXPYOCSLJXIP-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.42
Rot. Bonds5

About ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate

ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate (PubChem CID 60777245) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[cyclopropyl(propan-2-yl)amino]acetate
PubChem CID60777245
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Nameethyl 2-[cyclopropyl(propan-2-yl)amino]acetate
SMILESCCOC(=O)CN(C(C)C)C1CC1
InChIInChI=1S/C10H19NO2/c1-4-13-10(12)7-11(8(2)3)9-5-6-9/h8-9H,4-7H2,1-3H3
InChIKeyWIXXPYOCSLJXIP-UHFFFAOYSA-N
XLogP1.42
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate?
The IUPAC name of ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate (CID 60777245) is ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate.
What is the SMILES notation for ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate?
The canonical SMILES for ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate is CCOC(=O)CN(C(C)C)C1CC1.
What is the InChIKey of ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate?
The InChIKey is WIXXPYOCSLJXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-4-13-10(12)7-11(8(2)3)9-5-6-9/h8-9H,4-7H2,1-3H3.
What are the key properties of ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate?
ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate has a molecular weight of 185.27 g/mol, XLogP of 1.42, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[cyclopropyl(propan-2-yl)amino]acetate is sourced from PubChem (CID 60777245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).