2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride

C11H15ClFN — CID 131637709

IUPAC2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride
SMILESCl.NC(CC1CC1)c1ccc(F)cc1
InChIInChI=1S/C11H14FN.ClH/c12-10-5-3-9(4-6-10)11(13)7-8-1-2-8;/h3-6,8,11H,1-2,7,13H2;1H
InChIKeyJPHLIDXPTCQICQ-UHFFFAOYSA-N
MW215.70 g/mol
LogP3.05
Rot. Bonds3

About 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride

2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride (PubChem CID 131637709) has the molecular formula C11H15ClFN and a molecular weight of 215.70 g/mol. Its IUPAC name is 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride
PubChem CID131637709
Molecular FormulaC11H15ClFN
Molecular Weight215.70 g/mol
Exact Mass215.09
IUPAC Name2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride
SMILESCl.NC(CC1CC1)c1ccc(F)cc1
InChIInChI=1S/C11H14FN.ClH/c12-10-5-3-9(4-6-10)11(13)7-8-1-2-8;/h3-6,8,11H,1-2,7,13H2;1H
InChIKeyJPHLIDXPTCQICQ-UHFFFAOYSA-N
XLogP3.05
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.70
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-2-cyclopropyl-1-(4-fluorophenyl)ethanamine
CID 94248777
(1S)-1-(4-bromophenyl)-2-cyclopropylethanamine;hydrochloride
CID 171219224
1-(4-fluorophenyl)-2-pyrrolidin-3-ylethanamine
CID 116936082
2-cyclopropyl-1-(4-methylphenyl)ethanamine
CID 22649613
2-cyclopropyl-1-(3,5-difluorophenyl)ethanamine
CID 55272126
(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride
CID 171208431
(1S)-2-cyclopropyl-1-(4-ethylphenyl)ethanamine;hydrochloride
CID 171230824
(1S)-1-[4-(aminomethyl)phenyl]-2-cyclopropylethanamine
CID 150978200
(1R)-2-cyclopropyl-1-(4-methoxyphenyl)ethanamine;hydrochloride
CID 171200883
(1S)-2-cyclopropyl-1-(4-propan-2-yloxyphenyl)ethanamine;hydrochloride
CID 171230371
(1S)-2-cyclopropyl-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanamine;hydrochloride
CID 171222160
(1R)-2-cyclopropyl-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethanamine;hydrochloride
CID 171209483

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride?
The IUPAC name of 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride (CID 131637709) is 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride.
What is the SMILES notation for 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride?
The canonical SMILES for 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride is Cl.NC(CC1CC1)c1ccc(F)cc1.
What is the InChIKey of 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride?
The InChIKey is JPHLIDXPTCQICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN.ClH/c12-10-5-3-9(4-6-10)11(13)7-8-1-2-8;/h3-6,8,11H,1-2,7,13H2;1H.
What are the key properties of 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride?
2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride has a molecular weight of 215.70 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride is sourced from PubChem (CID 131637709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).