ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride

C11H20ClNO2 — CID 131964099

IUPACethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride
SMILESCCOC(=O)C1(C2CCNCC2)CC1.Cl
InChIInChI=1S/C11H19NO2.ClH/c1-2-14-10(13)11(5-6-11)9-3-7-12-8-4-9;/h9,12H,2-8H2,1H3;1H
InChIKeyZEKLLUBJJWADGD-UHFFFAOYSA-N
MW233.74 g/mol
LogP1.75
Rot. Bonds3

About ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride

ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride (PubChem CID 131964099) has the molecular formula C11H20ClNO2 and a molecular weight of 233.74 g/mol. Its IUPAC name is ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride.

Molecular Properties

Compound Nameethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride
PubChem CID131964099
Molecular FormulaC11H20ClNO2
Molecular Weight233.74 g/mol
Exact Mass233.12
IUPAC Nameethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride
SMILESCCOC(=O)C1(C2CCNCC2)CC1.Cl
InChIInChI=1S/C11H19NO2.ClH/c1-2-14-10(13)11(5-6-11)9-3-7-12-8-4-9;/h9,12H,2-8H2,1H3;1H
InChIKeyZEKLLUBJJWADGD-UHFFFAOYSA-N
XLogP1.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-azabicyclo[3.1.0]hexane-1-carboxylate;hydrochloride
CID 71757726
2-(1-ethoxycarbonylcyclopropyl)piperazine-1-carboxylic acid
CID 69392281
ethyl 1-(4-methyl-1,3-dioxetan-2-yl)cyclopropane-1-carboxylate
CID 67962947
ethyl acetate;piperidin-4-ol;hydrochloride
CID 174311482
ethyl 4-acetylpiperidine-4-carboxylate
CID 79001872
ethyl 1-(thiolan-2-yl)cyclopropane-1-carboxylate
CID 176838289
ethyl 3-piperazin-1-yl-1-azabicyclo[2.2.2]octane-3-carboxylate
CID 54894795
ethyl 3-methylpyrrolidine-3-carboxylate;hydrochloride
CID 71756654
4-ethoxycarbonylpiperidine-4-carboxylic acid;hydrobromide
CID 141202240
ethyl 4-acetylpiperidine-4-carboxylate;hydrobromide
CID 141202253
ethyl 4-cyano-3-methylpiperidine-3-carboxylate;hydrochloride
CID 177208929
ethyl 8-methyltricyclo[3.2.1.03,8]octane-3-carboxylate
CID 143508275

Frequently Asked Questions

What is the IUPAC name of ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride?
The IUPAC name of ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride (CID 131964099) is ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride.
What is the SMILES notation for ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride?
The canonical SMILES for ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride is CCOC(=O)C1(C2CCNCC2)CC1.Cl.
What is the InChIKey of ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride?
The InChIKey is ZEKLLUBJJWADGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2.ClH/c1-2-14-10(13)11(5-6-11)9-3-7-12-8-4-9;/h9,12H,2-8H2,1H3;1H.
What are the key properties of ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride?
ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride has a molecular weight of 233.74 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-piperidin-4-ylcyclopropane-1-carboxylate;hydrochloride is sourced from PubChem (CID 131964099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).