(2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol

C19H30N2O4 — CID 51927197

IUPAC(2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol
SMILESCOc1ccc(OC)c([C@H]2CCCN2C[C@H](O)CN2CCOCC2)c1
InChIInChI=1S/C19H30N2O4/c1-23-16-5-6-19(24-2)17(12-16)18-4-3-7-21(18)14-15(22)13-20-8-10-25-11-9-20/h5-6,12,15,18,22H,3-4,7-11,13-14H2,1-2H3/t15-,18-/m1/s1
InChIKeyQTZHNTONJKXWAH-CRAIPNDOSA-N
MW350.46 g/mol
LogP1.53
Rot. Bonds7

About (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol

(2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol (PubChem CID 51927197) has the molecular formula C19H30N2O4 and a molecular weight of 350.46 g/mol. Its IUPAC name is (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol
PubChem CID51927197
Molecular FormulaC19H30N2O4
Molecular Weight350.46 g/mol
Exact Mass350.22
IUPAC Name(2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol
SMILESCOc1ccc(OC)c([C@H]2CCCN2C[C@H](O)CN2CCOCC2)c1
InChIInChI=1S/C19H30N2O4/c1-23-16-5-6-19(24-2)17(12-16)18-4-3-7-21(18)14-15(22)13-20-8-10-25-11-9-20/h5-6,12,15,18,22H,3-4,7-11,13-14H2,1-2H3/t15-,18-/m1/s1
InChIKeyQTZHNTONJKXWAH-CRAIPNDOSA-N
XLogP1.53
TPSA54.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[2-(4-methoxyphenyl)azepan-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 110882272
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1-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol
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1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-(3-nitrophenoxy)propan-2-ol
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(2R)-1-[(2S)-2-(3-bromophenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 51963960
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CID 93240301
(2S)-1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-2-(2,5-dimethoxyphenyl)pyrrolidine
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1-[4-[(2S)-3-[(2S)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-hydroxypropoxy]phenyl]ethanone
CID 98445782
1-(2,5-dimethoxyphenyl)-2-morpholin-4-ylethanamine
CID 16780959
1-benzyl-2-(2,5-dimethoxyphenyl)piperidine
CID 102544473
2-[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-prop-2-ynylacetamide
CID 8833875
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Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol (CID 51927197) is (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol is COc1ccc(OC)c([C@H]2CCCN2C[C@H](O)CN2CCOCC2)c1.
What is the InChIKey of (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is QTZHNTONJKXWAH-CRAIPNDOSA-N. The full InChI is InChI=1S/C19H30N2O4/c1-23-16-5-6-19(24-2)17(12-16)18-4-3-7-21(18)14-15(22)13-20-8-10-25-11-9-20/h5-6,12,15,18,22H,3-4,7-11,13-14H2,1-2H3/t15-,18-/m1/s1.
What are the key properties of (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol?
(2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 350.46 g/mol, XLogP of 1.53, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 51927197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).