1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine

C15H24FNO — CID 113391483

IUPAC1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine
SMILESCCCNC(Cc1ccccc1F)CC(C)OC
InChIInChI=1S/C15H24FNO/c1-4-9-17-14(10-12(2)18-3)11-13-7-5-6-8-15(13)16/h5-8,12,14,17H,4,9-11H2,1-3H3
InChIKeyRPWNCKKPMARWAB-UHFFFAOYSA-N
MW253.36 g/mol
LogP3.16
Rot. Bonds8

About 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine

1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine (PubChem CID 113391483) has the molecular formula C15H24FNO and a molecular weight of 253.36 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine
PubChem CID113391483
Molecular FormulaC15H24FNO
Molecular Weight253.36 g/mol
Exact Mass253.18
IUPAC Name1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine
SMILESCCCNC(Cc1ccccc1F)CC(C)OC
InChIInChI=1S/C15H24FNO/c1-4-9-17-14(10-12(2)18-3)11-13-7-5-6-8-15(13)16/h5-8,12,14,17H,4,9-11H2,1-3H3
InChIKeyRPWNCKKPMARWAB-UHFFFAOYSA-N
XLogP3.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromophenyl)-3-(2-fluorophenyl)-N-propylpropan-2-amine
CID 63417230
1-(2-fluorophenyl)-4,4-dimethyl-N-propylpentan-2-amine
CID 61066309
1-(2-fluorophenyl)-3-methylsulfonyl-N-propylpropan-2-amine
CID 62472909
1-(2-fluorophenyl)-N-propyl-4-pyridin-2-ylbutan-2-amine
CID 105090087
1-(2-chloro-3-fluorophenyl)-4-methyl-N-propylpentan-2-amine
CID 112653600
1-(2-fluorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine
CID 79824475
6,6,6-trifluoro-1-(2-fluorophenyl)-N-propylhexan-2-amine
CID 115516510
N-[1-(2,6-difluorophenyl)-2-(2-fluorophenyl)ethyl]propan-1-amine
CID 61066311
1,1,1-trifluoro-3-(2-fluorophenyl)-N-propylpropan-2-amine
CID 66466100
4-ethyl-1-(2-methoxyphenyl)-N-propylhexan-2-amine
CID 82922595
1-[(2-fluorophenyl)methoxy]-N-propylbutan-2-amine
CID 63935309
N-[2-(2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]propan-1-amine
CID 103374768

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine?
The IUPAC name of 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine (CID 113391483) is 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine is CCCNC(Cc1ccccc1F)CC(C)OC.
What is the InChIKey of 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine?
The InChIKey is RPWNCKKPMARWAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FNO/c1-4-9-17-14(10-12(2)18-3)11-13-7-5-6-8-15(13)16/h5-8,12,14,17H,4,9-11H2,1-3H3.
What are the key properties of 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine?
1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine has a molecular weight of 253.36 g/mol, XLogP of 3.16, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-4-methoxy-N-propylpentan-2-amine is sourced from PubChem (CID 113391483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).