(1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol

C15H22N2O2 — CID 110157325

IUPAC(1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol
SMILESN[C@@H]1C[C@@H](Oc2ccccc2)[C@H](O)[C@H]1N1CCCC1
InChIInChI=1S/C15H22N2O2/c16-12-10-13(19-11-6-2-1-3-7-11)15(18)14(12)17-8-4-5-9-17/h1-3,6-7,12-15,18H,4-5,8-10,16H2/t12-,13-,14+,15+/m1/s1
InChIKeyAQHUHVKZMBDHNX-KBXIAJHMSA-N
MW262.35 g/mol
LogP0.99
Rot. Bonds3

About (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol

(1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol (PubChem CID 110157325) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol.

Molecular Properties

Compound Name(1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol
PubChem CID110157325
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name(1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol
SMILESN[C@@H]1C[C@@H](Oc2ccccc2)[C@H](O)[C@H]1N1CCCC1
InChIInChI=1S/C15H22N2O2/c16-12-10-13(19-11-6-2-1-3-7-11)15(18)14(12)17-8-4-5-9-17/h1-3,6-7,12-15,18H,4-5,8-10,16H2/t12-,13-,14+,15+/m1/s1
InChIKeyAQHUHVKZMBDHNX-KBXIAJHMSA-N
XLogP0.99
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol with MolForge

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Related Compounds

1-[4-[(1S,2R,3R,5R)-5-amino-2-hydroxy-3-phenoxycyclopentyl]piperazin-1-yl]ethanone;dihydrochloride
CID 171687457
(1R,2S,3R,5R)-3-amino-2-(4-phenylpiperazin-1-yl)-5-pyridin-3-yloxycyclopentan-1-ol
CID 110157304
1-[(1S,2R,3R,5R)-5-(dimethylsulfamoylamino)-2-hydroxy-3-phenoxycyclopentyl]pyrrolidine
CID 110157514
tert-butyl N-[(1S,2R,3S,4S)-3-hydroxy-4-phenoxy-2-pyrrolidin-1-ylcyclopentyl]carbamate
CID 110157706
N-[(1R,2S,3R,4R)-3-hydroxy-4-phenoxy-2-piperidin-1-ylcyclopentyl]oxane-4-carboxamide
CID 110157858
(1R,2S,3R,5R)-3-amino-2-(4-benzylpiperidin-1-yl)-5-(2-fluorophenoxy)cyclopentan-1-ol
CID 110155488
N-[(1R,2S,3R,4R)-3-hydroxy-4-phenoxy-2-piperidin-1-ylcyclopentyl]-3-methoxybenzamide
CID 110153321
N-[(1R,2S,3R,4R)-3-hydroxy-2-(4-methoxypiperidin-1-yl)-4-phenoxycyclopentyl]benzamide
CID 110157371
4-fluoro-N-[(1R,2S,3R,4R)-3-hydroxy-2-(4-hydroxypiperidin-1-yl)-4-phenoxycyclopentyl]benzamide
CID 110157992
(1S,2S,6R)-2-phenoxy-6-(4-phenylpiperazin-1-yl)cyclohexan-1-ol
CID 3065722
2-phenoxycyclooctan-1-ol
CID 22247671
N-[(1R,2S,3R,4R)-2-(4-acetylpiperazin-1-yl)-3-hydroxy-4-phenoxycyclopentyl]pyridine-2-carboxamide
CID 110157395

Frequently Asked Questions

What is the IUPAC name of (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol?
The IUPAC name of (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol (CID 110157325) is (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol.
What is the SMILES notation for (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol?
The canonical SMILES for (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol is N[C@@H]1C[C@@H](Oc2ccccc2)[C@H](O)[C@H]1N1CCCC1.
What is the InChIKey of (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol?
The InChIKey is AQHUHVKZMBDHNX-KBXIAJHMSA-N. The full InChI is InChI=1S/C15H22N2O2/c16-12-10-13(19-11-6-2-1-3-7-11)15(18)14(12)17-8-4-5-9-17/h1-3,6-7,12-15,18H,4-5,8-10,16H2/t12-,13-,14+,15+/m1/s1.
What are the key properties of (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol?
(1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol has a molecular weight of 262.35 g/mol, XLogP of 0.99, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S,3R,5R)-3-amino-5-phenoxy-2-pyrrolidin-1-ylcyclopentan-1-ol is sourced from PubChem (CID 110157325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).