N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine

C17H18FN — CID 79889960

IUPACN-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine
SMILESFc1ccc(CNCc2ccccc2C2CC2)cc1
InChIInChI=1S/C17H18FN/c18-16-9-5-13(6-10-16)11-19-12-15-3-1-2-4-17(15)14-7-8-14/h1-6,9-10,14,19H,7-8,11-12H2
InChIKeyZUVZVDMNEXNEAN-UHFFFAOYSA-N
MW255.34 g/mol
LogP3.99
Rot. Bonds5

About N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine

N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine (PubChem CID 79889960) has the molecular formula C17H18FN and a molecular weight of 255.34 g/mol. Its IUPAC name is N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine.

Molecular Properties

Compound NameN-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine
PubChem CID79889960
Molecular FormulaC17H18FN
Molecular Weight255.34 g/mol
Exact Mass255.14
IUPAC NameN-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine
SMILESFc1ccc(CNCc2ccccc2C2CC2)cc1
InChIInChI=1S/C17H18FN/c18-16-9-5-13(6-10-16)11-19-12-15-3-1-2-4-17(15)14-7-8-14/h1-6,9-10,14,19H,7-8,11-12H2
InChIKeyZUVZVDMNEXNEAN-UHFFFAOYSA-N
XLogP3.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-cyclopropylphenyl)-N-[(4-fluorophenyl)methyl]methanamine
CID 79979256
1-(2-cyclopropylphenyl)-N-(1H-pyrazol-4-ylmethyl)methanamine
CID 79979585
1-(2-cyclopropylphenyl)-N-[(2-methoxyphenyl)methyl]methanamine
CID 79889709
[2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol
CID 110906091
N-[[3-cyclopropyl-5-[[(4-fluorophenyl)methylamino]methyl]phenyl]methyl]-1-(4-fluorophenyl)methanamine
CID 66616571
1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride
CID 17289839
1-(4-fluorophenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
CID 834369
1-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]methanamine;hydrochloride
CID 17292771
N'-[(2-cyclopropylphenyl)methyl]propane-1,3-diamine
CID 79979438
2-[(2-cyclopropylphenyl)methylamino]acetic acid
CID 79979274
1-(4-cyclopropylphenyl)-N-[(2-methoxyphenyl)methyl]methanamine
CID 79979679
1-[(2-cyclopropylphenyl)methylamino]-2-methylpropan-2-ol
CID 79888885

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine?
The IUPAC name of N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine (CID 79889960) is N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine.
What is the SMILES notation for N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine?
The canonical SMILES for N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine is Fc1ccc(CNCc2ccccc2C2CC2)cc1.
What is the InChIKey of N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine?
The InChIKey is ZUVZVDMNEXNEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN/c18-16-9-5-13(6-10-16)11-19-12-15-3-1-2-4-17(15)14-7-8-14/h1-6,9-10,14,19H,7-8,11-12H2.
What are the key properties of N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine?
N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine has a molecular weight of 255.34 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine is sourced from PubChem (CID 79889960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).