(3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol

C21H32N2O3 — CID 31015761

IUPAC(3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol
SMILESO[C@@H]1CN(Cc2ccc(OC3CCCC3)cc2)CC[C@H]1N1CCOCC1
InChIInChI=1S/C21H32N2O3/c24-21-16-22(10-9-20(21)23-11-13-25-14-12-23)15-17-5-7-19(8-6-17)26-18-3-1-2-4-18/h5-8,18,20-21,24H,1-4,9-16H2/t20-,21-/m1/s1
InChIKeyRSDCREQZPJJIPV-NHCUHLMSSA-N
MW360.50 g/mol
LogP2.28
Rot. Bonds5

About (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol

(3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol (PubChem CID 31015761) has the molecular formula C21H32N2O3 and a molecular weight of 360.50 g/mol. Its IUPAC name is (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol.

Molecular Properties

Compound Name(3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol
PubChem CID31015761
Molecular FormulaC21H32N2O3
Molecular Weight360.50 g/mol
Exact Mass360.24
IUPAC Name(3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol
SMILESO[C@@H]1CN(Cc2ccc(OC3CCCC3)cc2)CC[C@H]1N1CCOCC1
InChIInChI=1S/C21H32N2O3/c24-21-16-22(10-9-20(21)23-11-13-25-14-12-23)15-17-5-7-19(8-6-17)26-18-3-1-2-4-18/h5-8,18,20-21,24H,1-4,9-16H2/t20-,21-/m1/s1
InChIKeyRSDCREQZPJJIPV-NHCUHLMSSA-N
XLogP2.28
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.50
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3S,4S)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpyrrolidin-3-ol
CID 56854894
4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine
CID 92641147
(3S,4S)-1-[(4-cyclopentyloxyphenyl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol
CID 56710189
(3R,4R)-1-benzyl-4-pyrrolidin-1-ylpiperidin-3-ol
CID 67310310
1-benzyl-4-piperidin-1-ylpiperidin-3-ol
CID 67311835
(3S,5R)-1-[2-[4-(oxan-4-yloxy)phenyl]ethyl]piperidine-3,4,5-triol
CID 166834263
(3R,4R)-1-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]-4-morpholin-4-ylpiperidin-3-ol
CID 45244684
(3R,4R)-1-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-4-morpholin-4-ylpiperidin-3-ol
CID 26390770
(3R,4R)-4-(azepan-1-yl)-1-[(3-chloro-4-ethoxyphenyl)methyl]piperidin-3-ol
CID 25454792
(3R,4R)-1-[[4-(difluoromethoxy)phenyl]methyl]-4-[4-(2-phenylethyl)piperazin-1-yl]piperidin-3-ol
CID 45232296
N-[4-[[(3S,4S)-4-(azepan-1-yl)-3-hydroxypiperidin-1-yl]methyl]phenyl]acetamide
CID 133133229
(3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-3-ol
CID 134706501

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol?
The IUPAC name of (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol (CID 31015761) is (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol.
What is the SMILES notation for (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol?
The canonical SMILES for (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol is O[C@@H]1CN(Cc2ccc(OC3CCCC3)cc2)CC[C@H]1N1CCOCC1.
What is the InChIKey of (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol?
The InChIKey is RSDCREQZPJJIPV-NHCUHLMSSA-N. The full InChI is InChI=1S/C21H32N2O3/c24-21-16-22(10-9-20(21)23-11-13-25-14-12-23)15-17-5-7-19(8-6-17)26-18-3-1-2-4-18/h5-8,18,20-21,24H,1-4,9-16H2/t20-,21-/m1/s1.
What are the key properties of (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol?
(3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol has a molecular weight of 360.50 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol is sourced from PubChem (CID 31015761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).