N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine

C19H18FN — CID 174517762

IUPACN-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine
SMILESFc1ccc(CNCCc2ccc3ccccc3c2)cc1
InChIInChI=1S/C19H18FN/c20-19-9-6-16(7-10-19)14-21-12-11-15-5-8-17-3-1-2-4-18(17)13-15/h1-10,13,21H,11-12,14H2
InChIKeyJKSYSCDFGSEGCM-UHFFFAOYSA-N
MW279.36 g/mol
LogP4.31
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine

N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine (PubChem CID 174517762) has the molecular formula C19H18FN and a molecular weight of 279.36 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine
PubChem CID174517762
Molecular FormulaC19H18FN
Molecular Weight279.36 g/mol
Exact Mass279.14
IUPAC NameN-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine
SMILESFc1ccc(CNCCc2ccc3ccccc3c2)cc1
InChIInChI=1S/C19H18FN/c20-19-9-6-16(7-10-19)14-21-12-11-15-5-8-17-3-1-2-4-18(17)13-15/h1-10,13,21H,11-12,14H2
InChIKeyJKSYSCDFGSEGCM-UHFFFAOYSA-N
XLogP4.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(4-fluorophenyl)methyl]-2-(3-methylphenyl)ethanamine
CID 62314975
6-[2-(benzylamino)ethyl]naphthalen-2-ol;hydrobromide
CID 20541959
N-(furan-2-ylmethyl)-2-naphthalen-2-ylethanamine
CID 54884386
N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)ethanamine
CID 4718091
N'-(naphthalen-2-ylmethyl)-N-[2-(naphthalen-2-ylmethylamino)ethyl]propane-1,3-diamine
CID 11741534
N-(2-naphthalen-2-ylethyl)formamide
CID 12581518
2-(1H-imidazol-5-yl)-N-(naphthalen-2-ylmethyl)ethanamine
CID 65230734
2-(4-fluorophenyl)-N-(2-naphthalen-2-ylethyl)cyclopropane-1-carboxamide
CID 78866705
3-(2-naphthalen-2-ylethylamino)propanoic acid
CID 115218333
N-[(4-fluorophenyl)methyl]-2-pyridin-2-ylethanamine
CID 13082717
2-(4-fluorophenyl)-N-[(3-phenylmethoxyphenyl)methyl]ethanamine;hydrochloride
CID 17292837
1-(4-methylsulfanylphenyl)-N-(naphthalen-2-ylmethyl)methanamine
CID 60584572

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine (CID 174517762) is N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine is Fc1ccc(CNCCc2ccc3ccccc3c2)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine?
The InChIKey is JKSYSCDFGSEGCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN/c20-19-9-6-16(7-10-19)14-21-12-11-15-5-8-17-3-1-2-4-18(17)13-15/h1-10,13,21H,11-12,14H2.
What are the key properties of N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine?
N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine has a molecular weight of 279.36 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-naphthalen-2-ylethanamine is sourced from PubChem (CID 174517762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).