5-fluoro-4-methoxy-2-propylaniline

C10H14FNO — CID 130537729

IUPAC5-fluoro-4-methoxy-2-propylaniline
SMILESCCCc1cc(OC)c(F)cc1N
InChIInChI=1S/C10H14FNO/c1-3-4-7-5-10(13-2)8(11)6-9(7)12/h5-6H,3-4,12H2,1-2H3
InChIKeyWFTYPPWXTOHXSU-UHFFFAOYSA-N
MW183.23 g/mol
LogP2.37
Rot. Bonds3

About 5-fluoro-4-methoxy-2-propylaniline

5-fluoro-4-methoxy-2-propylaniline (PubChem CID 130537729) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 5-fluoro-4-methoxy-2-propylaniline.

Molecular Properties

Compound Name5-fluoro-4-methoxy-2-propylaniline
PubChem CID130537729
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name5-fluoro-4-methoxy-2-propylaniline
SMILESCCCc1cc(OC)c(F)cc1N
InChIInChI=1S/C10H14FNO/c1-3-4-7-5-10(13-2)8(11)6-9(7)12/h5-6H,3-4,12H2,1-2H3
InChIKeyWFTYPPWXTOHXSU-UHFFFAOYSA-N
XLogP2.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,5-difluoro-4-methoxyaniline
CID 45090681
2-(4-fluoro-3,6-dimethoxy(213C)cyclohexa-1,3,5-trien-1-yl)ethanamine
CID 71493307
ethane;1-ethyl-5-fluoro-2-methoxy-4-propylbenzene
CID 168958922
4-fluoro-2-propylaniline
CID 23348947
2-(cyclopropylmethoxy)-5-fluoro-4-methoxyaniline
CID 63599683
1,5-difluoro-2-methoxy-3-propylbenzene
CID 176962400
7-fluoro-6-methoxy-N-methyl-3-propylquinolin-2-amine
CID 112674518
2-fluoro-5-methoxybenzene-1,4-diamine
CID 107258755
4-fluoro-2,6-dipropylaniline
CID 137443416
1-N-(2,2-dimethylbutyl)-4-fluoro-5-methoxybenzene-1,2-diamine
CID 103460154
5-fluoro-4-methoxy-2-(2,2,2-trifluoroethoxy)aniline
CID 63599497
1-(2,5-difluoro-4-methoxyphenyl)butan-2-amine
CID 170890367

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-methoxy-2-propylaniline?
The IUPAC name of 5-fluoro-4-methoxy-2-propylaniline (CID 130537729) is 5-fluoro-4-methoxy-2-propylaniline.
What is the SMILES notation for 5-fluoro-4-methoxy-2-propylaniline?
The canonical SMILES for 5-fluoro-4-methoxy-2-propylaniline is CCCc1cc(OC)c(F)cc1N.
What is the InChIKey of 5-fluoro-4-methoxy-2-propylaniline?
The InChIKey is WFTYPPWXTOHXSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-3-4-7-5-10(13-2)8(11)6-9(7)12/h5-6H,3-4,12H2,1-2H3.
What are the key properties of 5-fluoro-4-methoxy-2-propylaniline?
5-fluoro-4-methoxy-2-propylaniline has a molecular weight of 183.23 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-methoxy-2-propylaniline is sourced from PubChem (CID 130537729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).