2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride

C9H10Cl2FN — CID 45265682

IUPAC2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride
SMILESCl.NC1CC1(F)c1ccc(Cl)cc1
InChIInChI=1S/C9H9ClFN.ClH/c10-7-3-1-6(2-4-7)9(11)5-8(9)12;/h1-4,8H,5,12H2;1H
InChIKeySNQFVRIUQWMWDA-UHFFFAOYSA-N
MW222.09 g/mol
LogP2.66
Rot. Bonds1

About 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride

2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride (PubChem CID 45265682) has the molecular formula C9H10Cl2FN and a molecular weight of 222.09 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride
PubChem CID45265682
Molecular FormulaC9H10Cl2FN
Molecular Weight222.09 g/mol
Exact Mass221.02
IUPAC Name2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride
SMILESCl.NC1CC1(F)c1ccc(Cl)cc1
InChIInChI=1S/C9H9ClFN.ClH/c10-7-3-1-6(2-4-7)9(11)5-8(9)12;/h1-4,8H,5,12H2;1H
InChIKeySNQFVRIUQWMWDA-UHFFFAOYSA-N
XLogP2.66
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.09
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride?
The IUPAC name of 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride (CID 45265682) is 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride.
What is the SMILES notation for 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride?
The canonical SMILES for 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride is Cl.NC1CC1(F)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride?
The InChIKey is SNQFVRIUQWMWDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClFN.ClH/c10-7-3-1-6(2-4-7)9(11)5-8(9)12;/h1-4,8H,5,12H2;1H.
What are the key properties of 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride?
2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride has a molecular weight of 222.09 g/mol, XLogP of 2.66, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-fluorocyclopropan-1-amine;hydrochloride is sourced from PubChem (CID 45265682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).