1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine

C17H18FN — CID 71207055

IUPAC1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine
SMILESCNCC1CC1c1cccc(-c2ccc(F)cc2)c1
InChIInChI=1S/C17H18FN/c1-19-11-15-10-17(15)14-4-2-3-13(9-14)12-5-7-16(18)8-6-12/h2-9,15,17,19H,10-11H2,1H3
InChIKeyYGIMQZGIJJSJDD-UHFFFAOYSA-N
MW255.34 g/mol
LogP3.82
Rot. Bonds4

About 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine

1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine (PubChem CID 71207055) has the molecular formula C17H18FN and a molecular weight of 255.34 g/mol. Its IUPAC name is 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine
PubChem CID71207055
Molecular FormulaC17H18FN
Molecular Weight255.34 g/mol
Exact Mass255.14
IUPAC Name1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine
SMILESCNCC1CC1c1cccc(-c2ccc(F)cc2)c1
InChIInChI=1S/C17H18FN/c1-19-11-15-10-17(15)14-4-2-3-13(9-14)12-5-7-16(18)8-6-12/h2-9,15,17,19H,10-11H2,1H3
InChIKeyYGIMQZGIJJSJDD-UHFFFAOYSA-N
XLogP3.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine?
The IUPAC name of 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine (CID 71207055) is 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine is CNCC1CC1c1cccc(-c2ccc(F)cc2)c1.
What is the InChIKey of 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine?
The InChIKey is YGIMQZGIJJSJDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN/c1-19-11-15-10-17(15)14-4-2-3-13(9-14)12-5-7-16(18)8-6-12/h2-9,15,17,19H,10-11H2,1H3.
What are the key properties of 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine?
1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine has a molecular weight of 255.34 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[3-(4-fluorophenyl)phenyl]cyclopropyl]-N-methylmethanamine is sourced from PubChem (CID 71207055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).