2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine

C12H16FN — CID 55297664

IUPAC2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine
SMILESCc1ccc(F)c(C(N)CC2CC2)c1
InChIInChI=1S/C12H16FN/c1-8-2-5-11(13)10(6-8)12(14)7-9-3-4-9/h2,5-6,9,12H,3-4,7,14H2,1H3
InChIKeyARXDRDBSIUMMFH-UHFFFAOYSA-N
MW193.26 g/mol
LogP2.93
Rot. Bonds3

About 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine

2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine (PubChem CID 55297664) has the molecular formula C12H16FN and a molecular weight of 193.26 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine
PubChem CID55297664
Molecular FormulaC12H16FN
Molecular Weight193.26 g/mol
Exact Mass193.13
IUPAC Name2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine
SMILESCc1ccc(F)c(C(N)CC2CC2)c1
InChIInChI=1S/C12H16FN/c1-8-2-5-11(13)10(6-8)12(14)7-9-3-4-9/h2,5-6,9,12H,3-4,7,14H2,1H3
InChIKeyARXDRDBSIUMMFH-UHFFFAOYSA-N
XLogP2.93
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.26
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-2-cyclopropyl-1-[2-fluoro-5-(trifluoromethyl)phenyl]ethanamine
CID 171209533
[2-cyclobutyl-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105309984
cyclobutyl-(2-fluoro-5-methylphenyl)methanamine
CID 64986676
2-cyclopentylsulfanyl-1-(2-fluoro-5-methylphenyl)ethanamine
CID 65138658
(1R)-2-cyclopropyl-1-(2-fluoro-5-nitrophenyl)ethanamine
CID 171205959
(1R)-1-(2-fluoro-5-methylphenyl)butane-1,4-diamine
CID 171204011
2-cyclopropyl-1-(2,3,4-trifluorophenyl)ethanamine
CID 79016147
(1S)-1-(4-chloro-2-methylphenyl)-2-cyclopropylethanamine
CID 131029260
2-cyclopentyl-1-(2,4-dimethylphenyl)ethanamine
CID 43825536
3,3,3-trifluoro-1-(2-fluoro-5-methylphenyl)propan-1-amine
CID 62790891
(1R)-2-cyclopropyl-1-(2,3-difluoro-4-methylphenyl)ethanamine
CID 131568971
(1S)-1-(2-fluoro-5-methylphenyl)pent-4-en-1-amine
CID 171223608

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine?
The IUPAC name of 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine (CID 55297664) is 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine?
The canonical SMILES for 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine is Cc1ccc(F)c(C(N)CC2CC2)c1.
What is the InChIKey of 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine?
The InChIKey is ARXDRDBSIUMMFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-8-2-5-11(13)10(6-8)12(14)7-9-3-4-9/h2,5-6,9,12H,3-4,7,14H2,1H3.
What are the key properties of 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine?
2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine has a molecular weight of 193.26 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine is sourced from PubChem (CID 55297664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).