1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine

C12H16FN — CID 117283964

IUPAC1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine
SMILESCc1cc(F)ccc1C1(C(C)N)CC1
InChIInChI=1S/C12H16FN/c1-8-7-10(13)3-4-11(8)12(5-6-12)9(2)14/h3-4,7,9H,5-6,14H2,1-2H3
InChIKeyCJPAMZNPHWVONY-UHFFFAOYSA-N
MW193.26 g/mol
LogP2.51
Rot. Bonds2

About 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine

1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine (PubChem CID 117283964) has the molecular formula C12H16FN and a molecular weight of 193.26 g/mol. Its IUPAC name is 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine
PubChem CID117283964
Molecular FormulaC12H16FN
Molecular Weight193.26 g/mol
Exact Mass193.13
IUPAC Name1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine
SMILESCc1cc(F)ccc1C1(C(C)N)CC1
InChIInChI=1S/C12H16FN/c1-8-7-10(13)3-4-11(8)12(5-6-12)9(2)14/h3-4,7,9H,5-6,14H2,1-2H3
InChIKeyCJPAMZNPHWVONY-UHFFFAOYSA-N
XLogP2.51
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.26
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-(1-aminoethyl)cyclopropyl]-4-fluoro-N,N-dimethylaniline
CID 117318626
1-[1-(2,4-difluoro-3-methylphenyl)cyclopropyl]ethanamine
CID 117301571
5-[1-(1-aminoethyl)cyclopropyl]-4-fluoro-2-methylphenol
CID 117298840
5-[1-(1-aminoethyl)cyclopropyl]-2-fluoro-4-methylbenzoic acid
CID 117346746
1-[1-(2-bromo-4-methylphenyl)cyclopropyl]ethanamine
CID 117388136
1-[1-(2,3-difluoro-5-methylphenyl)cyclopropyl]ethanamine
CID 117301565
1-[1-(6-fluoro-2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanamine
CID 117312920
4-[1-(1-aminoethyl)cyclopropyl]-2,3-difluorophenol
CID 117303739
1-(4-fluoro-2-methylphenyl)cyclobutan-1-ol
CID 79081119
(4-fluoro-2-methylphenyl)-(1-phenylcyclopropyl)methanamine
CID 63078447
1-(4-fluoro-2-methylphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 63407272
2-[1-(1-aminoethyl)cyclopropyl]-4,5-dimethylbenzaldehyde
CID 117309973

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine?
The IUPAC name of 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine (CID 117283964) is 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine.
What is the SMILES notation for 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine?
The canonical SMILES for 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine is Cc1cc(F)ccc1C1(C(C)N)CC1.
What is the InChIKey of 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine?
The InChIKey is CJPAMZNPHWVONY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-8-7-10(13)3-4-11(8)12(5-6-12)9(2)14/h3-4,7,9H,5-6,14H2,1-2H3.
What are the key properties of 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine?
1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine has a molecular weight of 193.26 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine is sourced from PubChem (CID 117283964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).