2-(2-fluoro-6-methylphenyl)propan-1-amine

C10H14FN — CID 84765270

IUPAC2-(2-fluoro-6-methylphenyl)propan-1-amine
SMILESCc1cccc(F)c1C(C)CN
InChIInChI=1S/C10H14FN/c1-7-4-3-5-9(11)10(7)8(2)6-12/h3-5,8H,6,12H2,1-2H3
InChIKeyZOXFTABXHHEWIA-UHFFFAOYSA-N
MW167.23 g/mol
LogP2.20
Rot. Bonds2

About 2-(2-fluoro-6-methylphenyl)propan-1-amine

2-(2-fluoro-6-methylphenyl)propan-1-amine (PubChem CID 84765270) has the molecular formula C10H14FN and a molecular weight of 167.23 g/mol. Its IUPAC name is 2-(2-fluoro-6-methylphenyl)propan-1-amine.

Molecular Properties

Compound Name2-(2-fluoro-6-methylphenyl)propan-1-amine
PubChem CID84765270
Molecular FormulaC10H14FN
Molecular Weight167.23 g/mol
Exact Mass167.11
IUPAC Name2-(2-fluoro-6-methylphenyl)propan-1-amine
SMILESCc1cccc(F)c1C(C)CN
InChIInChI=1S/C10H14FN/c1-7-4-3-5-9(11)10(7)8(2)6-12/h3-5,8H,6,12H2,1-2H3
InChIKeyZOXFTABXHHEWIA-UHFFFAOYSA-N
XLogP2.20
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.23
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(2-fluoro-6-methylphenyl)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

2-(2-bromo-3-fluoro-6-methylphenyl)propan-1-amine
CID 117367099
2-(3-bromo-2-fluoro-6-methylphenyl)propan-1-amine
CID 84803107
2-(2,5-difluoro-3,6-dimethylphenyl)propan-1-amine
CID 117288685
2-butan-2-yl-1,3-difluorobenzene
CID 56605716
2-(3-bromo-2,6-difluorophenyl)propan-1-amine
CID 106943854
2-N-[1-(2,6-difluorophenyl)ethyl]propane-1,2-diamine
CID 103389171
2-(5-fluoronaphthalen-1-yl)propan-1-amine
CID 105455459
2-(3,6-difluoro-2-methoxyphenyl)propan-1-amine
CID 117290019
(1R)-1-(2,6-difluorophenyl)ethane-1,2-diamine;hydrochloride
CID 171223663
(2R)-2-amino-2-(2-fluoro-6-methylphenyl)acetic acid
CID 130997783
(1S)-1-(2-amino-6-fluorophenyl)ethane-1,2-diamine
CID 66516155
2-[1-(2-fluorophenyl)-3,5-dimethylpyrazol-4-yl]propan-1-amine
CID 79218757

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-6-methylphenyl)propan-1-amine?
The IUPAC name of 2-(2-fluoro-6-methylphenyl)propan-1-amine (CID 84765270) is 2-(2-fluoro-6-methylphenyl)propan-1-amine.
What is the SMILES notation for 2-(2-fluoro-6-methylphenyl)propan-1-amine?
The canonical SMILES for 2-(2-fluoro-6-methylphenyl)propan-1-amine is Cc1cccc(F)c1C(C)CN.
What is the InChIKey of 2-(2-fluoro-6-methylphenyl)propan-1-amine?
The InChIKey is ZOXFTABXHHEWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN/c1-7-4-3-5-9(11)10(7)8(2)6-12/h3-5,8H,6,12H2,1-2H3.
What are the key properties of 2-(2-fluoro-6-methylphenyl)propan-1-amine?
2-(2-fluoro-6-methylphenyl)propan-1-amine has a molecular weight of 167.23 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-6-methylphenyl)propan-1-amine is sourced from PubChem (CID 84765270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).