2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine

C20H20FNO — CID 83973798

IUPAC2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine
SMILESCOc1ccc2ccccc2c1CC(CN)c1ccc(F)cc1
InChIInChI=1S/C20H20FNO/c1-23-20-11-8-15-4-2-3-5-18(15)19(20)12-16(13-22)14-6-9-17(21)10-7-14/h2-11,16H,12-13,22H2,1H3
InChIKeyPRSKYNFUKQHURK-UHFFFAOYSA-N
MW309.38 g/mol
LogP4.27
Rot. Bonds5

About 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine

2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine (PubChem CID 83973798) has the molecular formula C20H20FNO and a molecular weight of 309.38 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine
PubChem CID83973798
Molecular FormulaC20H20FNO
Molecular Weight309.38 g/mol
Exact Mass309.15
IUPAC Name2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine
SMILESCOc1ccc2ccccc2c1CC(CN)c1ccc(F)cc1
InChIInChI=1S/C20H20FNO/c1-23-20-11-8-15-4-2-3-5-18(15)19(20)12-16(13-22)14-6-9-17(21)10-7-14/h2-11,16H,12-13,22H2,1H3
InChIKeyPRSKYNFUKQHURK-UHFFFAOYSA-N
XLogP4.27
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.38
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)-3-(2,4,5-trimethoxyphenyl)propan-1-amine
CID 83973785
3-(2-ethoxy-3-methoxyphenyl)-2-(4-fluorophenyl)propan-1-amine
CID 83973795
2-(4-fluorophenyl)-3-(2-propan-2-yloxyphenyl)propan-1-amine
CID 82160549
(2R)-1-(2-methoxynaphthalen-1-yl)propan-2-ol
CID 92532795
1-(2-methoxynaphthalen-1-yl)butan-2-amine;hydrochloride
CID 170888490
2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine
CID 21148412
3-(2-fluoro-3-methoxyphenyl)-2-phenylpropan-1-amine
CID 82812600
2-(4-fluorophenyl)-3-(2-methoxy-3-propoxyphenyl)propan-1-amine
CID 82160452
3-(2-bromophenyl)-2-(4-fluorophenyl)propan-1-amine
CID 79442108
4-[3-amino-2-(4-fluorophenyl)propyl]-2-chloro-6-methoxyphenol
CID 82160859
3-(2-chloro-6-fluorophenyl)-2-(3,4-dimethoxyphenyl)propan-1-amine
CID 82139829
2-(4-fluorophenyl)-3-(2-pentoxyphenyl)propan-1-amine
CID 82160370

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine?
The IUPAC name of 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine (CID 83973798) is 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine.
What is the SMILES notation for 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine?
The canonical SMILES for 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine is COc1ccc2ccccc2c1CC(CN)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine?
The InChIKey is PRSKYNFUKQHURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FNO/c1-23-20-11-8-15-4-2-3-5-18(15)19(20)12-16(13-22)14-6-9-17(21)10-7-14/h2-11,16H,12-13,22H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine?
2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine has a molecular weight of 309.38 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine is sourced from PubChem (CID 83973798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).