azane;ethyl cyclopropanecarboxylate;hydrochloride

C6H14ClNO2 — CID 174491802

IUPACazane;ethyl cyclopropanecarboxylate;hydrochloride
SMILESCCOC(=O)C1CC1.Cl.N
InChIInChI=1S/C6H10O2.ClH.H3N/c1-2-8-6(7)5-3-4-5;;/h5H,2-4H2,1H3;1H;1H3
InChIKeyOISKKPVUOHZDNR-UHFFFAOYSA-N
MW167.64 g/mol
LogP1.54
Rot. Bonds2

About azane;ethyl cyclopropanecarboxylate;hydrochloride

azane;ethyl cyclopropanecarboxylate;hydrochloride (PubChem CID 174491802) has the molecular formula C6H14ClNO2 and a molecular weight of 167.64 g/mol. Its IUPAC name is azane;ethyl cyclopropanecarboxylate;hydrochloride.

Molecular Properties

Compound Nameazane;ethyl cyclopropanecarboxylate;hydrochloride
PubChem CID174491802
Molecular FormulaC6H14ClNO2
Molecular Weight167.64 g/mol
Exact Mass167.07
IUPAC Nameazane;ethyl cyclopropanecarboxylate;hydrochloride
SMILESCCOC(=O)C1CC1.Cl.N
InChIInChI=1S/C6H10O2.ClH.H3N/c1-2-8-6(7)5-3-4-5;;/h5H,2-4H2,1H3;1H;1H3
InChIKeyOISKKPVUOHZDNR-UHFFFAOYSA-N
XLogP1.54
TPSA61.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.64
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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ethyl 4-chlorocyclohexane-1-carboxylate
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diethyl cyclopentane-1,3-dicarboxylate
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ethyl 4-(2-aminoethyl)cyclohexane-1-carboxylate;hydrochloride
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ethyl 1-methylpiperidine-4-carboxylate;hydrochloride
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ethyl 4-deuterio-4-(trideuteriomethyl)cyclohexane-1-carboxylate
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ethyl 4-(methylaminomethyl)cyclohexane-1-carboxylate
CID 20757661
ethyl 4-hydroxycyclohexane-1-carboxylate;4-hydroxycyclohexane-1-carboxylic acid
CID 161494785
(4-ethoxycarbonylcyclohexyl)oxythallium;phosphane;sulfanide
CID 58512073
ethyl 4-(difluoromethyl)cyclohexane-1-carboxylate
CID 59569173
ethyl cyclobutanecarboxylate;formic acid
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Frequently Asked Questions

What is the IUPAC name of azane;ethyl cyclopropanecarboxylate;hydrochloride?
The IUPAC name of azane;ethyl cyclopropanecarboxylate;hydrochloride (CID 174491802) is azane;ethyl cyclopropanecarboxylate;hydrochloride.
What is the SMILES notation for azane;ethyl cyclopropanecarboxylate;hydrochloride?
The canonical SMILES for azane;ethyl cyclopropanecarboxylate;hydrochloride is CCOC(=O)C1CC1.Cl.N.
What is the InChIKey of azane;ethyl cyclopropanecarboxylate;hydrochloride?
The InChIKey is OISKKPVUOHZDNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O2.ClH.H3N/c1-2-8-6(7)5-3-4-5;;/h5H,2-4H2,1H3;1H;1H3.
What are the key properties of azane;ethyl cyclopropanecarboxylate;hydrochloride?
azane;ethyl cyclopropanecarboxylate;hydrochloride has a molecular weight of 167.64 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;ethyl cyclopropanecarboxylate;hydrochloride is sourced from PubChem (CID 174491802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).