ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate

C11H19NO2 — CID 154585692

IUPACethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate
SMILESCCOC(=O)C1CCCC1NC1CC1
InChIInChI=1S/C11H19NO2/c1-2-14-11(13)9-4-3-5-10(9)12-8-6-7-8/h8-10,12H,2-7H2,1H3
InChIKeyBDVJQCXJTQVGQQ-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.47
Rot. Bonds4

About ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate

ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate (PubChem CID 154585692) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate.

Molecular Properties

Compound Nameethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate
PubChem CID154585692
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Nameethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate
SMILESCCOC(=O)C1CCCC1NC1CC1
InChIInChI=1S/C11H19NO2/c1-2-14-11(13)9-4-3-5-10(9)12-8-6-7-8/h8-10,12H,2-7H2,1H3
InChIKeyBDVJQCXJTQVGQQ-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate?
The IUPAC name of ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate (CID 154585692) is ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate.
What is the SMILES notation for ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate?
The canonical SMILES for ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate is CCOC(=O)C1CCCC1NC1CC1.
What is the InChIKey of ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate?
The InChIKey is BDVJQCXJTQVGQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-2-14-11(13)9-4-3-5-10(9)12-8-6-7-8/h8-10,12H,2-7H2,1H3.
What are the key properties of ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate?
ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate has a molecular weight of 197.28 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(cyclopropylamino)cyclopentane-1-carboxylate is sourced from PubChem (CID 154585692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).