(2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol

C19H30N2O3 — CID 97243448

IUPAC(2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol
SMILESC[C@H]1CCCN(c2ccccc2OC[C@H](O)CN2CCOCC2)C1
InChIInChI=1S/C19H30N2O3/c1-16-5-4-8-21(13-16)18-6-2-3-7-19(18)24-15-17(22)14-20-9-11-23-12-10-20/h2-3,6-7,16-17,22H,4-5,8-15H2,1H3/t16-,17+/m0/s1
InChIKeyFCUSUYNDTORAFN-DLBZAZTESA-N
MW334.46 g/mol
LogP1.99
Rot. Bonds6

About (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol

(2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol (PubChem CID 97243448) has the molecular formula C19H30N2O3 and a molecular weight of 334.46 g/mol. Its IUPAC name is (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol
PubChem CID97243448
Molecular FormulaC19H30N2O3
Molecular Weight334.46 g/mol
Exact Mass334.23
IUPAC Name(2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol
SMILESC[C@H]1CCCN(c2ccccc2OC[C@H](O)CN2CCOCC2)C1
InChIInChI=1S/C19H30N2O3/c1-16-5-4-8-21(13-16)18-6-2-3-7-19(18)24-15-17(22)14-20-9-11-23-12-10-20/h2-3,6-7,16-17,22H,4-5,8-15H2,1H3/t16-,17+/m0/s1
InChIKeyFCUSUYNDTORAFN-DLBZAZTESA-N
XLogP1.99
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-1-ethoxy-3-[2-[(3R)-3-methylpiperidin-1-yl]phenoxy]propan-2-ol
CID 124733596
1-(2-fluorophenoxy)-3-(3-methylpiperidin-1-yl)propan-2-ol
CID 3659665
(2S)-1-(2-chlorophenoxy)-3-morpholin-4-ylpropan-2-ol
CID 34207051
(2S)-1-[(3S)-3-methylpiperidin-1-yl]-3-phenoxypropan-2-ol
CID 7447463
1-(2,3-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol
CID 16798644
1-(3-methylpiperidin-1-yl)-3-morpholin-4-ylpropan-2-ol
CID 110879064
(2S)-1-(2-methylphenoxy)-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 769296
1-(2-chlorophenoxy)-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 18823227
1-(2-bromophenoxy)-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 4085306
1-(2,3-dihydro-1H-inden-4-yloxy)-3-morpholin-4-ylpropan-2-ol
CID 3051477
1-morpholin-4-yl-3-quinolin-8-yloxypropan-2-ol
CID 3069803
1-morpholin-4-yl-3-(4-pyrrolidin-1-ylphenoxy)propan-2-ol
CID 109416651

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol (CID 97243448) is (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol is C[C@H]1CCCN(c2ccccc2OC[C@H](O)CN2CCOCC2)C1.
What is the InChIKey of (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is FCUSUYNDTORAFN-DLBZAZTESA-N. The full InChI is InChI=1S/C19H30N2O3/c1-16-5-4-8-21(13-16)18-6-2-3-7-19(18)24-15-17(22)14-20-9-11-23-12-10-20/h2-3,6-7,16-17,22H,4-5,8-15H2,1H3/t16-,17+/m0/s1.
What are the key properties of (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol?
(2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 334.46 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 97243448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).