2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate

C11H19NO2 — CID 106202522

IUPAC2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate
SMILESNC1(C(=O)OCCC2CC2)CCCC1
InChIInChI=1S/C11H19NO2/c12-11(6-1-2-7-11)10(13)14-8-5-9-3-4-9/h9H,1-8,12H2
InChIKeyKRVTXTOSFGSUMA-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.60
Rot. Bonds4

About 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate

2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate (PubChem CID 106202522) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate.

Molecular Properties

Compound Name2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate
PubChem CID106202522
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate
SMILESNC1(C(=O)OCCC2CC2)CCCC1
InChIInChI=1S/C11H19NO2/c12-11(6-1-2-7-11)10(13)14-8-5-9-3-4-9/h9H,1-8,12H2
InChIKeyKRVTXTOSFGSUMA-UHFFFAOYSA-N
XLogP1.60
TPSA52.32 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 ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Cyclopentanecarboxylic acid, 1-amino-, ethyl ester
CID 222862
Methyl 1-amino-1-cyclopentanecarboxylate (H-Ac5c-OMe)
CID 231225
Ethyl 1-aminocyclopentane-1-carboxylate hydrochloride
CID 3028134
Tert-butyl 1-aminocyclopentane-1-carboxylate
CID 14161653
Ethyl 2-ethylnorleucinate
CID 42614420
rac-methyl (1R,2R)-1-amino-2-ethylcyclopropane-1-carboxylate hydrochloride
CID 68561780
rac-methyl (1R,2S)-1-amino-2-(propan-2-yl)cyclopropane-1-carboxylate hydrochloride
CID 146155234
Isopropyl 1-aminocyclopentanecarboxylate hydrochloride
CID 3028135
Ethyl 6-aminobicyclo[3.1.0]hexane-6-carboxylate hydrochloride
CID 165920061
Ethyl 2-amino-2-ethyl-4-methylpentanoate
CID 86211634
Diethyl amino ethyl hexanoate
CID 140979147
(1S,2S)-Methyl 1-amino-2-isopropylcyclopropanecarboxylate
CID 124653524

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate?
The IUPAC name of 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate (CID 106202522) is 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate.
What is the SMILES notation for 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate?
The canonical SMILES for 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate is NC1(C(=O)OCCC2CC2)CCCC1.
What is the InChIKey of 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate?
The InChIKey is KRVTXTOSFGSUMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c12-11(6-1-2-7-11)10(13)14-8-5-9-3-4-9/h9H,1-8,12H2.
What are the key properties of 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate?
2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate has a molecular weight of 197.28 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylethyl 1-aminocyclopentane-1-carboxylate is sourced from PubChem (CID 106202522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).