(2R)-2-[(1S)-1-phenylpropyl]pyrrolidine

C13H19N — CID 7047899

IUPAC(2R)-2-[(1S)-1-phenylpropyl]pyrrolidine
SMILESCC[C@@H](c1ccccc1)[C@H]1CCCN1
InChIInChI=1S/C13H19N/c1-2-12(13-9-6-10-14-13)11-7-4-3-5-8-11/h3-5,7-8,12-14H,2,6,9-10H2,1H3/t12-,13+/m0/s1
InChIKeyLISOICDQKSFEOD-QWHCGFSZSA-N
MW189.30 g/mol
LogP2.93
Rot. Bonds3

About (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine

(2R)-2-[(1S)-1-phenylpropyl]pyrrolidine (PubChem CID 7047899) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine.

Molecular Properties

Compound Name(2R)-2-[(1S)-1-phenylpropyl]pyrrolidine
PubChem CID7047899
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name(2R)-2-[(1S)-1-phenylpropyl]pyrrolidine
SMILESCC[C@@H](c1ccccc1)[C@H]1CCCN1
InChIInChI=1S/C13H19N/c1-2-12(13-9-6-10-14-13)11-7-4-3-5-8-11/h3-5,7-8,12-14H,2,6,9-10H2,1H3/t12-,13+/m0/s1
InChIKeyLISOICDQKSFEOD-QWHCGFSZSA-N
XLogP2.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-[(1R)-1-phenylpropyl]pyrrolidine
CID 7047905
(2R)-2-[(1R)-1-phenylpropyl]pyrrolidine
CID 7047901
2-(1-phenylpropyl)pyrrolidine;hydrochloride
CID 17389655
(2R)-2-[(1R)-1-phenylethyl]pyrrolidine
CID 95732426
phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
CID 68687169
(1R)-N-methyl-1-phenyl-1-[(2S)-pyrrolidin-2-yl]methanamine
CID 132599012
2,2-diphenyl-1-pyrrolidin-2-ylethanol
CID 69294076
2,2-diphenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 118229705
2,2-diphenyl-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 68647594
2-[1-[3-fluoro-4-(trifluoromethyl)phenyl]propyl]pyrrolidine
CID 144524441
(2S)-2-phenyl-2-[(2S)-piperidin-2-yl]acetonitrile
CID 95396519
(2R)-2-phenyl-2-[(2S)-piperidin-2-yl]acetonitrile
CID 95396518

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine?
The IUPAC name of (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine (CID 7047899) is (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine.
What is the SMILES notation for (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine?
The canonical SMILES for (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine is CC[C@@H](c1ccccc1)[C@H]1CCCN1.
What is the InChIKey of (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine?
The InChIKey is LISOICDQKSFEOD-QWHCGFSZSA-N. The full InChI is InChI=1S/C13H19N/c1-2-12(13-9-6-10-14-13)11-7-4-3-5-8-11/h3-5,7-8,12-14H,2,6,9-10H2,1H3/t12-,13+/m0/s1.
What are the key properties of (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine?
(2R)-2-[(1S)-1-phenylpropyl]pyrrolidine has a molecular weight of 189.30 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 (2R)-2-[(1S)-1-phenylpropyl]pyrrolidine is sourced from PubChem (CID 7047899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).