N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine

C19H22FN — CID 79431035

IUPACN-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine
SMILESCc1ccccc1CC(CNC1CC1)c1ccc(F)cc1
InChIInChI=1S/C19H22FN/c1-14-4-2-3-5-16(14)12-17(13-21-19-10-11-19)15-6-8-18(20)9-7-15/h2-9,17,19,21H,10-13H2,1H3
InChIKeyQYLUNBIPOFRTIW-UHFFFAOYSA-N
MW283.39 g/mol
LogP4.21
Rot. Bonds6

About N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine

N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine (PubChem CID 79431035) has the molecular formula C19H22FN and a molecular weight of 283.39 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine
PubChem CID79431035
Molecular FormulaC19H22FN
Molecular Weight283.39 g/mol
Exact Mass283.17
IUPAC NameN-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine
SMILESCc1ccccc1CC(CNC1CC1)c1ccc(F)cc1
InChIInChI=1S/C19H22FN/c1-14-4-2-3-5-16(14)12-17(13-21-19-10-11-19)15-6-8-18(20)9-7-15/h2-9,17,19,21H,10-13H2,1H3
InChIKeyQYLUNBIPOFRTIW-UHFFFAOYSA-N
XLogP4.21
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[3-(5-fluoro-2-methylphenyl)-2-phenylpropyl]cyclopropanamine
CID 81027097
N-[2-(4-bromophenyl)-3-(2-fluorophenyl)propyl]cyclopropanamine
CID 79430772
3-(cyclopropylamino)-2-(4-fluorophenyl)propan-1-ol
CID 117244719
N-[3-(2-fluorophenyl)-2-(3-methylphenyl)propyl]cyclopropanamine
CID 79422729
N-[3-(3-bromophenyl)-2-(4-fluorophenyl)propyl]cyclopropanamine
CID 79431040
N-[3-(2-bromophenyl)-2-(3-fluorophenyl)propyl]cyclopropanamine
CID 79432897
N-[2-(4-fluorophenyl)-3-(oxolan-2-yl)propyl]cyclopropanamine
CID 79437936
N-[5-ethoxy-2-(4-fluorophenyl)pentyl]cyclopropanamine
CID 79438193
N-[2-(2-methylphenyl)butyl]cyclopropanamine
CID 79421511
N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine
CID 65430983
N-[2-(4-bromophenyl)-3-(3-fluorophenyl)propyl]cyclopropanamine
CID 79430769
N-[2-[(5-chlorothiophen-2-yl)methyl]-3-(2-methylphenyl)propyl]cyclopropanamine
CID 63523373

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine?
The IUPAC name of N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine (CID 79431035) is N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine.
What is the SMILES notation for N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine?
The canonical SMILES for N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine is Cc1ccccc1CC(CNC1CC1)c1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine?
The InChIKey is QYLUNBIPOFRTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN/c1-14-4-2-3-5-16(14)12-17(13-21-19-10-11-19)15-6-8-18(20)9-7-15/h2-9,17,19,21H,10-13H2,1H3.
What are the key properties of N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine?
N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine has a molecular weight of 283.39 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)-3-(2-methylphenyl)propyl]cyclopropanamine is sourced from PubChem (CID 79431035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).