(R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine

C12H16FN — CID 131122532

IUPAC(R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine
SMILESCCc1ccc(F)cc1[C@H](N)C1CC1
InChIInChI=1S/C12H16FN/c1-2-8-5-6-10(13)7-11(8)12(14)9-3-4-9/h5-7,9,12H,2-4,14H2,1H3/t12-/m1/s1
InChIKeyNJTRFJMTEMAFGP-GFCCVEGCSA-N
MW193.26 g/mol
LogP2.80
Rot. Bonds3

About (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine

(R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine (PubChem CID 131122532) has the molecular formula C12H16FN and a molecular weight of 193.26 g/mol. Its IUPAC name is (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine.

Molecular Properties

Compound Name(R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine
PubChem CID131122532
Molecular FormulaC12H16FN
Molecular Weight193.26 g/mol
Exact Mass193.13
IUPAC Name(R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine
SMILESCCc1ccc(F)cc1[C@H](N)C1CC1
InChIInChI=1S/C12H16FN/c1-2-8-5-6-10(13)7-11(8)12(14)9-3-4-9/h5-7,9,12H,2-4,14H2,1H3/t12-/m1/s1
InChIKeyNJTRFJMTEMAFGP-GFCCVEGCSA-N
XLogP2.80
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 ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-(2-ethyl-5-fluorophenyl)ethanamine
CID 130619359
1-(2-ethyl-5-fluorophenyl)butan-1-amine
CID 55268868
(2-bromo-5-fluorophenyl)-cyclopropylmethanamine
CID 71743656
(4-butylcyclohexyl)-(2,5-difluorophenyl)methanamine
CID 43100104
1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine
CID 55273260
(R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine
CID 97290671
(3S)-3-amino-3-(2-ethyl-5-fluorophenyl)propanenitrile
CID 130658086
(S)-(2-chloro-5-fluorophenyl)-cyclopentylmethanamine
CID 131512229
2-[(R)-amino(cyclopropyl)methyl]-5-fluorobenzoic acid
CID 131869097
(S)-cyclopropyl-(4-fluoro-2-methoxyphenyl)methanamine;hydrochloride
CID 171224902
1-cyclopropyl-2-(4-fluoro-2-methylphenyl)ethanamine
CID 114347649
cyclopentyl-(4-fluoro-2-methylphenyl)methanamine
CID 62790372

Frequently Asked Questions

What is the IUPAC name of (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine?
The IUPAC name of (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine (CID 131122532) is (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine.
What is the SMILES notation for (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine?
The canonical SMILES for (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine is CCc1ccc(F)cc1[C@H](N)C1CC1.
What is the InChIKey of (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine?
The InChIKey is NJTRFJMTEMAFGP-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H16FN/c1-2-8-5-6-10(13)7-11(8)12(14)9-3-4-9/h5-7,9,12H,2-4,14H2,1H3/t12-/m1/s1.
What are the key properties of (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine?
(R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine has a molecular weight of 193.26 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine is sourced from PubChem (CID 131122532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).