cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride

C11H15Cl2N — CID 118730219

IUPACcis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride
SMILESCC[C@]1(N)C[C@@H]1c1cccc(Cl)c1.Cl
InChIInChI=1S/C11H14ClN.ClH/c1-2-11(13)7-10(11)8-4-3-5-9(12)6-8;/h3-6,10H,2,7,13H2,1H3;1H/t10-,11+;/m1./s1
InChIKeyGUTLLJXZOVJDNT-DHXVBOOMSA-N
MW232.15 g/mol
LogP3.36
Rot. Bonds2

About cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride

cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride (PubChem CID 118730219) has the molecular formula C11H15Cl2N and a molecular weight of 232.15 g/mol. Its IUPAC name is cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride.

Molecular Properties

Compound Namecis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride
PubChem CID118730219
Molecular FormulaC11H15Cl2N
Molecular Weight232.15 g/mol
Exact Mass231.06
IUPAC Namecis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride
SMILESCC[C@]1(N)C[C@@H]1c1cccc(Cl)c1.Cl
InChIInChI=1S/C11H14ClN.ClH/c1-2-11(13)7-10(11)8-4-3-5-9(12)6-8;/h3-6,10H,2,7,13H2,1H3;1H/t10-,11+;/m1./s1
InChIKeyGUTLLJXZOVJDNT-DHXVBOOMSA-N
XLogP3.36
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.15
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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(1R,2S)-1-methyl-2-phenylcyclopropan-1-amine hydrochloride
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(1S,2R)-1-methyl-2-phenylcyclopropan-1-aminehydrochloride
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(1R,2S)-1-ethyl-2-phenyl-cyclopropanamine hydrochloride
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trans-(1R,2R)-1-ethyl-2-phenylcyclopropan-1-amine;hydrochloride
CID 90197459
cis-(1S,2R)-1-ethyl-2-phenylcyclopropan-1-amine;hydrochloride
CID 90197969
1-(3-Chlorophenyl)propan-2-amine hydrochloride
CID 42943439
[(1S,2S)-2-(2,3-dichlorophenyl)cyclopropyl]methanamine;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride?
The IUPAC name of cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride (CID 118730219) is cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride.
What is the SMILES notation for cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride?
The canonical SMILES for cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride is CC[C@]1(N)C[C@@H]1c1cccc(Cl)c1.Cl.
What is the InChIKey of cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride?
The InChIKey is GUTLLJXZOVJDNT-DHXVBOOMSA-N. The full InChI is InChI=1S/C11H14ClN.ClH/c1-2-11(13)7-10(11)8-4-3-5-9(12)6-8;/h3-6,10H,2,7,13H2,1H3;1H/t10-,11+;/m1./s1.
What are the key properties of cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride?
cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride has a molecular weight of 232.15 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-(3-chlorophenyl)-1-ethylcyclopropan-1-amine;hydrochloride is sourced from PubChem (CID 118730219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).