N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine

C19H22FN — CID 114871531

IUPACN-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCC(NC1CCc2ccccc2C1)c1cccc(F)c1
InChIInChI=1S/C19H22FN/c1-2-19(16-8-5-9-17(20)12-16)21-18-11-10-14-6-3-4-7-15(14)13-18/h3-9,12,18-19,21H,2,10-11,13H2,1H3
InChIKeyYYGDYUGUGDHTRO-UHFFFAOYSA-N
MW283.39 g/mol
LogP4.42
Rot. Bonds4

About N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine

N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 114871531) has the molecular formula C19H22FN and a molecular weight of 283.39 g/mol. Its IUPAC name is N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID114871531
Molecular FormulaC19H22FN
Molecular Weight283.39 g/mol
Exact Mass283.17
IUPAC NameN-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCC(NC1CCc2ccccc2C1)c1cccc(F)c1
InChIInChI=1S/C19H22FN/c1-2-19(16-8-5-9-17(20)12-16)21-18-11-10-14-6-3-4-7-15(14)13-18/h3-9,12,18-19,21H,2,10-11,13H2,1H3
InChIKeyYYGDYUGUGDHTRO-UHFFFAOYSA-N
XLogP4.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(2-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115994378
N-[1-(3-fluorophenyl)propyl]oxolan-3-amine
CID 114871720
N-[1-(3-fluorophenyl)propyl]-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 114871649
N-(1-thiophen-2-ylpropyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 55153023
5-fluoro-N-(1-phenylpropyl)-2,3-dihydro-1H-inden-1-amine
CID 115623709
N-[1-(3-fluorophenyl)propyl]-1,1-dioxothian-3-amine
CID 114871597
N-[1-(3-fluorophenyl)propyl]-2,2-dimethylcyclopropan-1-amine
CID 114871515
N-[(1S)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 81351587
3-(3-fluorophenyl)-N-(1-phenylpropyl)cyclobutan-1-amine
CID 62304356
(2S)-2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]butan-1-ol
CID 93026650
N-[1-(3-bromophenyl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43426726
(1R)-1-(3-fluorophenyl)-N-methylpropan-1-amine
CID 93312415

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine (CID 114871531) is N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine is CCC(NC1CCc2ccccc2C1)c1cccc(F)c1.
What is the InChIKey of N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is YYGDYUGUGDHTRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN/c1-2-19(16-8-5-9-17(20)12-16)21-18-11-10-14-6-3-4-7-15(14)13-18/h3-9,12,18-19,21H,2,10-11,13H2,1H3.
What are the key properties of N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine?
N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 283.39 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 114871531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).