2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine

C11H14FNO — CID 62389721

IUPAC2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine
SMILESCOc1ccc(C2(C)CC2N)cc1F
InChIInChI=1S/C11H14FNO/c1-11(6-10(11)13)7-3-4-9(14-2)8(12)5-7/h3-5,10H,6,13H2,1-2H3
InChIKeyRWSHRYQXYVGPLO-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.82
Rot. Bonds2

About 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine

2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine (PubChem CID 62389721) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine.

Molecular Properties

Compound Name2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine
PubChem CID62389721
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine
SMILESCOc1ccc(C2(C)CC2N)cc1F
InChIInChI=1S/C11H14FNO/c1-11(6-10(11)13)7-3-4-9(14-2)8(12)5-7/h3-5,10H,6,13H2,1-2H3
InChIKeyRWSHRYQXYVGPLO-UHFFFAOYSA-N
XLogP1.82
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dimethoxyphenyl)-2-methylcyclopropan-1-amine
CID 62387494
3-amino-1-(3-fluoro-4-methoxyphenyl)cyclobutan-1-ol
CID 80561285
[1-(3-fluoro-4-methoxyphenyl)cyclobutyl]methanamine
CID 131328420
4-(2,2-dimethylcyclopropyl)-2-fluoro-1-methoxybenzene
CID 165178047
1-(3-fluoro-4-methoxyphenyl)cyclobutan-1-amine;hydrochloride
CID 162691811
1-(3-fluoro-4-methoxyphenyl)-2-propylcyclopropan-1-ol
CID 79332815
2-(3-methoxyphenyl)-2-methylcyclopropan-1-amine
CID 62389909
3-cyclopropyl-1-(3-fluoro-4-methoxyphenyl)cyclohexan-1-amine
CID 64595065
3-(3-fluoro-4-methoxyphenyl)-9-azabicyclo[3.3.1]nonan-3-ol
CID 171961618
3-(3-fluoro-4-methoxyphenyl)-5,5-dimethylcyclohex-2-en-1-amine
CID 65177140
3-(3-fluoro-4-methoxyphenyl)-8,8-dioxo-8λ6-thiabicyclo[3.2.1]octan-3-ol
CID 171961617
1-(3-fluoro-4-methoxyphenyl)-3-methoxycyclohexan-1-ol
CID 106874129

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine?
The IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine (CID 62389721) is 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine.
What is the SMILES notation for 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine?
The canonical SMILES for 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine is COc1ccc(C2(C)CC2N)cc1F.
What is the InChIKey of 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine?
The InChIKey is RWSHRYQXYVGPLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-11(6-10(11)13)7-3-4-9(14-2)8(12)5-7/h3-5,10H,6,13H2,1-2H3.
What are the key properties of 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine?
2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine has a molecular weight of 195.24 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-methoxyphenyl)-2-methylcyclopropan-1-amine is sourced from PubChem (CID 62389721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).