3-fluoro-2-(3-methoxyphenyl)propan-1-amine

C10H14FNO — CID 83817226

IUPAC3-fluoro-2-(3-methoxyphenyl)propan-1-amine
SMILESCOc1cccc(C(CN)CF)c1
InChIInChI=1S/C10H14FNO/c1-13-10-4-2-3-8(5-10)9(6-11)7-12/h2-5,9H,6-7,12H2,1H3
InChIKeyNUFPVRNFGWBTOA-UHFFFAOYSA-N
MW183.23 g/mol
LogP1.71
Rot. Bonds4

About 3-fluoro-2-(3-methoxyphenyl)propan-1-amine

3-fluoro-2-(3-methoxyphenyl)propan-1-amine (PubChem CID 83817226) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 3-fluoro-2-(3-methoxyphenyl)propan-1-amine.

Molecular Properties

Compound Name3-fluoro-2-(3-methoxyphenyl)propan-1-amine
PubChem CID83817226
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name3-fluoro-2-(3-methoxyphenyl)propan-1-amine
SMILESCOc1cccc(C(CN)CF)c1
InChIInChI=1S/C10H14FNO/c1-13-10-4-2-3-8(5-10)9(6-11)7-12/h2-5,9H,6-7,12H2,1H3
InChIKeyNUFPVRNFGWBTOA-UHFFFAOYSA-N
XLogP1.71
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-fluoro-2-(3-methoxyphenyl)propan-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

4-(4-fluorophenoxy)-2-(3-methoxyphenyl)butan-1-amine
CID 82138439
2-(3-methoxyphenyl)-3-methylsulfonylpropan-1-amine
CID 117242945
2-(3-methoxyphenyl)-5-(4-methylphenoxy)pentan-1-amine
CID 82138429
1-(3-methoxyphenyl)ethane-1,2-diamine;dihydrochloride
CID 138109115
1-(1,3-dichloropropan-2-yl)-3-methoxybenzene
CID 70178746
4-amino-2-(3-methoxyphenyl)butan-1-ol
CID 115020276
4-amino-N-ethyl-3-(3-methoxyphenyl)butanamide
CID 112511303
2-(3-methoxyphenyl)-3-(3-propoxyphenyl)propan-1-amine
CID 83972606
4-[3-amino-2-(3-methoxyphenyl)propyl]-2-bromophenol
CID 83972592
4-[3-amino-2-(3-methoxyphenyl)propyl]benzoic acid
CID 82139721
4-[3-amino-2-(3-methoxyphenyl)propyl]-2-methoxyphenol
CID 83972582
2-(3-methoxyphenyl)-3-(4-propoxyphenyl)propan-1-amine
CID 83972609

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(3-methoxyphenyl)propan-1-amine?
The IUPAC name of 3-fluoro-2-(3-methoxyphenyl)propan-1-amine (CID 83817226) is 3-fluoro-2-(3-methoxyphenyl)propan-1-amine.
What is the SMILES notation for 3-fluoro-2-(3-methoxyphenyl)propan-1-amine?
The canonical SMILES for 3-fluoro-2-(3-methoxyphenyl)propan-1-amine is COc1cccc(C(CN)CF)c1.
What is the InChIKey of 3-fluoro-2-(3-methoxyphenyl)propan-1-amine?
The InChIKey is NUFPVRNFGWBTOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-13-10-4-2-3-8(5-10)9(6-11)7-12/h2-5,9H,6-7,12H2,1H3.
What are the key properties of 3-fluoro-2-(3-methoxyphenyl)propan-1-amine?
3-fluoro-2-(3-methoxyphenyl)propan-1-amine has a molecular weight of 183.23 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(3-methoxyphenyl)propan-1-amine is sourced from PubChem (CID 83817226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).