[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride

C10H13ClFN — CID 68924561

IUPAC[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride
SMILESCl.NC[C@@H]1C[C@H]1c1cccc(F)c1
InChIInChI=1S/C10H12FN.ClH/c11-9-3-1-2-7(4-9)10-5-8(10)6-12;/h1-4,8,10H,5-6,12H2;1H/t8-,10-;/m0./s1
InChIKeyAXSMTSASKAIQRQ-GNAZCLTHSA-N
MW201.67 g/mol
LogP2.31
Rot. Bonds2

About [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride

[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride (PubChem CID 68924561) has the molecular formula C10H13ClFN and a molecular weight of 201.67 g/mol. Its IUPAC name is [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride.

Molecular Properties

Compound Name[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride
PubChem CID68924561
Molecular FormulaC10H13ClFN
Molecular Weight201.67 g/mol
Exact Mass201.07
IUPAC Name[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride
SMILESCl.NC[C@@H]1C[C@H]1c1cccc(F)c1
InChIInChI=1S/C10H12FN.ClH/c11-9-3-1-2-7(4-9)10-5-8(10)6-12;/h1-4,8,10H,5-6,12H2;1H/t8-,10-;/m0./s1
InChIKeyAXSMTSASKAIQRQ-GNAZCLTHSA-N
XLogP2.31
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.67
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(3-fluorophenyl)cyclopropyl]methanol
CID 53275735
[4-ethyl-2-(3-fluorophenyl)cyclohexyl]methanamine
CID 81010427
3-[(2R)-2-(aminomethyl)cyclopropyl]phenol
CID 105432221
[(1R,2S)-2-[3-(trifluoromethyl)phenyl]cyclopropyl]methanamine
CID 94557656
[(1S,2R)-2-[3-(trifluoromethyl)phenyl]cyclopropyl]methanamine
CID 94557654
[(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine
CID 68928221
[(1R,2R)-2-(3,4-difluorophenyl)cyclopropyl]methanamine
CID 94556780
[(1R,2S)-2-(2,4-difluorophenyl)cyclopropyl]methanamine
CID 94556815
[(1S,2S)-2-(2-chloro-4-fluorophenyl)cyclopropyl]methanamine;hydrochloride
CID 44572165
[2-(3-ethynylphenyl)cyclopropyl]methanamine
CID 75074269
3-[(1R,2R)-2-(aminomethyl)cyclopropyl]benzonitrile
CID 94556811
[(1R,2R)-2-[3-[4-(trifluoromethyl)phenyl]phenyl]cyclopropyl]methanamine;hydrochloride
CID 68922618

Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride?
The IUPAC name of [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride (CID 68924561) is [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride.
What is the SMILES notation for [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride?
The canonical SMILES for [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride is Cl.NC[C@@H]1C[C@H]1c1cccc(F)c1.
What is the InChIKey of [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride?
The InChIKey is AXSMTSASKAIQRQ-GNAZCLTHSA-N. The full InChI is InChI=1S/C10H12FN.ClH/c11-9-3-1-2-7(4-9)10-5-8(10)6-12;/h1-4,8,10H,5-6,12H2;1H/t8-,10-;/m0./s1.
What are the key properties of [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride?
[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride has a molecular weight of 201.67 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride is sourced from PubChem (CID 68924561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).