(2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine

C11H15FN2 — CID 124709830

IUPAC(2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine
SMILESCN1CC[C@@H](N)[C@H]1c1ccc(F)cc1
InChIInChI=1S/C11H15FN2/c1-14-7-6-10(13)11(14)8-2-4-9(12)5-3-8/h2-5,10-11H,6-7,13H2,1H3/t10-,11-/m1/s1
InChIKeyPGLORIOSCWIJBZ-GHMZBOCLSA-N
MW194.25 g/mol
LogP1.53
Rot. Bonds1

About (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine

(2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine (PubChem CID 124709830) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name(2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine
PubChem CID124709830
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name(2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine
SMILESCN1CC[C@@H](N)[C@H]1c1ccc(F)cc1
InChIInChI=1S/C11H15FN2/c1-14-7-6-10(13)11(14)8-2-4-9(12)5-3-8/h2-5,10-11H,6-7,13H2,1H3/t10-,11-/m1/s1
InChIKeyPGLORIOSCWIJBZ-GHMZBOCLSA-N
XLogP1.53
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R)-2-(4-fluorophenyl)-1-(2-methoxyethyl)pyrrolidin-3-amine
CID 150837589
2-(5-chloro-2-fluorophenyl)-1-methylpyrrolidin-3-amine
CID 114866692
3-amino-2-(4-fluorophenyl)piperidine-1-carboxylic acid
CID 138597714
[3-(4-fluorophenyl)-1-methylpyrrolidin-2-yl]methanamine
CID 105462010
5-(3-amino-1-methylpiperidin-2-yl)-2-fluorobenzonitrile
CID 107936960
[(2R,3S)-1-methyl-2-[4-(trifluoromethyl)phenyl]pyrrolidin-3-yl]methanamine
CID 95240602
2-(3-bromofuran-2-yl)-1-methylpyrrolidin-3-amine
CID 106889460
[(2S,3R)-2-(4-methoxyphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 91647555
[1,2-bis(4-fluorophenyl)pyrrolidin-3-yl]methanamine;hydrochloride
CID 70084109
2-(6-methoxy-3-pyridinyl)-1-methylpiperidin-3-amine
CID 114938614
methyl 4-(4-fluorophenyl)-1-methylpiperidine-2-carboxylate
CID 54404104
(1R)-2-(4-fluorophenyl)cyclopentan-1-amine
CID 70223067

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine?
The IUPAC name of (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine (CID 124709830) is (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine.
What is the SMILES notation for (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine?
The canonical SMILES for (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine is CN1CC[C@@H](N)[C@H]1c1ccc(F)cc1.
What is the InChIKey of (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine?
The InChIKey is PGLORIOSCWIJBZ-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H15FN2/c1-14-7-6-10(13)11(14)8-2-4-9(12)5-3-8/h2-5,10-11H,6-7,13H2,1H3/t10-,11-/m1/s1.
What are the key properties of (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine?
(2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine has a molecular weight of 194.25 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-amine is sourced from PubChem (CID 124709830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).