N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine

C19H18FN — CID 43178671

IUPACN-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine
SMILESCC(NCc1ccc(F)cc1)c1cccc2ccccc12
InChIInChI=1S/C19H18FN/c1-14(21-13-15-9-11-17(20)12-10-15)18-8-4-6-16-5-2-3-7-19(16)18/h2-12,14,21H,13H2,1H3
InChIKeyNQQFHGJOMHKKAN-UHFFFAOYSA-N
MW279.36 g/mol
LogP4.83
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine

N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine (PubChem CID 43178671) has the molecular formula C19H18FN and a molecular weight of 279.36 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine
PubChem CID43178671
Molecular FormulaC19H18FN
Molecular Weight279.36 g/mol
Exact Mass279.14
IUPAC NameN-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine
SMILESCC(NCc1ccc(F)cc1)c1cccc2ccccc12
InChIInChI=1S/C19H18FN/c1-14(21-13-15-9-11-17(20)12-10-15)18-8-4-6-16-5-2-3-7-19(16)18/h2-12,14,21H,13H2,1H3
InChIKeyNQQFHGJOMHKKAN-UHFFFAOYSA-N
XLogP4.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-naphthalen-1-yl-N-[[4-(trifluoromethyl)phenyl]methyl]ethanamine
CID 70834221
N-[(4-ethoxyphenyl)methyl]-1-naphthalen-1-ylethanamine
CID 60590175
1-naphthalen-1-yl-N-(pyrimidin-5-ylmethyl)ethanamine
CID 62759136
(1R)-N-[[4-(ethoxymethoxy)phenyl]methyl]-1-naphthalen-1-ylethanamine
CID 97258214
N-[(4-fluorophenyl)methyl]-1-phenylethanamine
CID 2758971
N-[(4-chlorophenyl)methyl]-2-[[(1R)-1-naphthalen-1-ylethyl]amino]acetamide
CID 9396902
(1R)-N-benzyl-1-(4-fluoronaphthalen-1-yl)ethanamine
CID 141381257
N-[(2-fluoro-5-methylphenyl)methyl]-1-naphthalen-1-ylethanamine
CID 143626004
(1R)-1-naphthalen-1-yl-N-[[3-(2-phenylethynyl)phenyl]methyl]ethanamine
CID 59562831
2-[3-[[[(1R)-1-naphthalen-1-ylethyl]amino]methyl]phenyl]propan-2-amine
CID 70834368
(1R)-N-[(4-ethoxy-3-methylphenyl)methyl]-1-naphthalen-1-ylethanamine
CID 25197103
N-[(9-ethylcarbazol-3-yl)methyl]-1-naphthalen-1-ylethanamine
CID 21087531

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine?
The IUPAC name of N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine (CID 43178671) is N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine is CC(NCc1ccc(F)cc1)c1cccc2ccccc12.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine?
The InChIKey is NQQFHGJOMHKKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN/c1-14(21-13-15-9-11-17(20)12-10-15)18-8-4-6-16-5-2-3-7-19(16)18/h2-12,14,21H,13H2,1H3.
What are the key properties of N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine?
N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine has a molecular weight of 279.36 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-1-naphthalen-1-ylethanamine is sourced from PubChem (CID 43178671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).