1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride

C18H17ClFN — CID 17289839

IUPAC1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride
SMILESCl.Fc1ccc(CNCc2cccc3ccccc23)cc1
InChIInChI=1S/C18H16FN.ClH/c19-17-10-8-14(9-11-17)12-20-13-16-6-3-5-15-4-1-2-7-18(15)16;/h1-11,20H,12-13H2;1H
InChIKeyKLEUUQAHBULXSF-UHFFFAOYSA-N
MW301.79 g/mol
LogP4.69
Rot. Bonds4

About 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride

1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride (PubChem CID 17289839) has the molecular formula C18H17ClFN and a molecular weight of 301.79 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride
PubChem CID17289839
Molecular FormulaC18H17ClFN
Molecular Weight301.79 g/mol
Exact Mass301.10
IUPAC Name1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride
SMILESCl.Fc1ccc(CNCc2cccc3ccccc23)cc1
InChIInChI=1S/C18H16FN.ClH/c19-17-10-8-14(9-11-17)12-20-13-16-6-3-5-15-4-1-2-7-18(15)16;/h1-11,20H,12-13H2;1H
InChIKeyKLEUUQAHBULXSF-UHFFFAOYSA-N
XLogP4.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.79
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N'-(naphthalen-1-ylmethyl)-N-[[4-[[2-(naphthalen-1-ylmethylamino)ethylamino]methyl]phenyl]methyl]ethane-1,2-diamine
CID 102025774
1-(4-fluorophenyl)-N-(isoquinolin-4-ylmethyl)methanamine
CID 115748158
1-(4-bromophenyl)-N-(naphthalen-1-ylmethyl)methanamine
CID 10782345
[2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol
CID 110906091
1-[(4-fluorophenyl)methyl]naphthalene
CID 11118033
N-[(2,6-difluorophenyl)methyl]-1-naphthalen-1-ylmethanamine
CID 62047867
1-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]methanamine;hydrochloride
CID 17292771
1-(3,4-dichlorophenyl)-N-(naphthalen-1-ylmethyl)methanamine
CID 63478519
1-(4-fluorophenyl)-N-[(3-methoxy-2-phenylmethoxyphenyl)methyl]methanamine;hydrochloride
CID 17292639
1-(4-fluorophenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
CID 834369
2-[[(4-fluorophenyl)methylamino]methyl]benzoic acid;hydrochloride
CID 17158189
1-(4-fluorophenyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine
CID 78978650

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride?
The IUPAC name of 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride (CID 17289839) is 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride?
The canonical SMILES for 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride is Cl.Fc1ccc(CNCc2cccc3ccccc23)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride?
The InChIKey is KLEUUQAHBULXSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN.ClH/c19-17-10-8-14(9-11-17)12-20-13-16-6-3-5-15-4-1-2-7-18(15)16;/h1-11,20H,12-13H2;1H.
What are the key properties of 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride?
1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride has a molecular weight of 301.79 g/mol, XLogP of 4.69, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride is sourced from PubChem (CID 17289839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).