1-(3-fluorophenyl)-2-methoxypropan-1-amine

C10H14FNO — CID 79616556

IUPAC1-(3-fluorophenyl)-2-methoxypropan-1-amine
SMILESCOC(C)C(N)c1cccc(F)c1
InChIInChI=1S/C10H14FNO/c1-7(13-2)10(12)8-4-3-5-9(11)6-8/h3-7,10H,12H2,1-2H3
InChIKeyNIPIRZPMTSGRNW-UHFFFAOYSA-N
MW183.23 g/mol
LogP1.86
Rot. Bonds3

About 1-(3-fluorophenyl)-2-methoxypropan-1-amine

1-(3-fluorophenyl)-2-methoxypropan-1-amine (PubChem CID 79616556) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-2-methoxypropan-1-amine.

Molecular Properties

Compound Name1-(3-fluorophenyl)-2-methoxypropan-1-amine
PubChem CID79616556
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name1-(3-fluorophenyl)-2-methoxypropan-1-amine
SMILESCOC(C)C(N)c1cccc(F)c1
InChIInChI=1S/C10H14FNO/c1-7(13-2)10(12)8-4-3-5-9(11)6-8/h3-7,10H,12H2,1-2H3
InChIKeyNIPIRZPMTSGRNW-UHFFFAOYSA-N
XLogP1.86
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 ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-fluorophenyl)-2-methoxypropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-fluorophenyl)-methoxymethanamine
CID 116947347
1-(3-fluorophenyl)-4-methoxypentan-1-amine
CID 105092989
2,2-difluoro-1-(3-fluorophenyl)ethanamine
CID 79002278
(1S)-2,2-difluoro-1-(3-fluorophenyl)ethanamine;hydrochloride
CID 171245936
N-[1-(3-fluorophenyl)ethyl]-3-methoxybutan-2-amine
CID 115704684
(1S,2R)-1-amino-1-(3-fluorophenyl)-3-methylbutan-2-ol;hydrochloride
CID 171161576
1-(3-fluorophenyl)-2-methoxyethanamine
CID 45283501
(1R,2S)-1-amino-1-(3-fluorophenyl)-4-methylpentan-2-ol
CID 171160142
1-(3-fluorophenyl)-3-methoxybutan-2-amine
CID 79615959
(1R,2S)-1-amino-1-(3-fluorophenyl)butan-2-ol
CID 131021466
1-(5-fluoro-2-methylphenyl)-2-methoxypropan-1-amine
CID 79616557
2-amino-1-(3-fluorophenyl)-3-methylbutan-1-ol
CID 82282052

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-2-methoxypropan-1-amine?
The IUPAC name of 1-(3-fluorophenyl)-2-methoxypropan-1-amine (CID 79616556) is 1-(3-fluorophenyl)-2-methoxypropan-1-amine.
What is the SMILES notation for 1-(3-fluorophenyl)-2-methoxypropan-1-amine?
The canonical SMILES for 1-(3-fluorophenyl)-2-methoxypropan-1-amine is COC(C)C(N)c1cccc(F)c1.
What is the InChIKey of 1-(3-fluorophenyl)-2-methoxypropan-1-amine?
The InChIKey is NIPIRZPMTSGRNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-7(13-2)10(12)8-4-3-5-9(11)6-8/h3-7,10H,12H2,1-2H3.
What are the key properties of 1-(3-fluorophenyl)-2-methoxypropan-1-amine?
1-(3-fluorophenyl)-2-methoxypropan-1-amine has a molecular weight of 183.23 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-2-methoxypropan-1-amine is sourced from PubChem (CID 79616556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).