(2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol

C11H17NO3 — CID 97180175

IUPAC(2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol
SMILESCOc1ccccc1COC[C@H](O)CN
InChIInChI=1S/C11H17NO3/c1-14-11-5-3-2-4-9(11)7-15-8-10(13)6-12/h2-5,10,13H,6-8,12H2,1H3/t10-/m1/s1
InChIKeyFVLWSVPFAZFPOQ-SNVBAGLBSA-N
MW211.26 g/mol
LogP0.53
Rot. Bonds6

About (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol

(2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol (PubChem CID 97180175) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol
PubChem CID97180175
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name(2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol
SMILESCOc1ccccc1COC[C@H](O)CN
InChIInChI=1S/C11H17NO3/c1-14-11-5-3-2-4-9(11)7-15-8-10(13)6-12/h2-5,10,13H,6-8,12H2,1H3/t10-/m1/s1
InChIKeyFVLWSVPFAZFPOQ-SNVBAGLBSA-N
XLogP0.53
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-1-amino-3-[(2,4-dimethoxyphenyl)methoxy]propan-2-ol
CID 97180181
1-amino-3-[(2,4,5-trimethoxyphenyl)methoxy]propan-2-ol
CID 102548264
(2S)-1-amino-3-[(2,4,5-trimethoxyphenyl)methoxy]propan-2-ol
CID 97180192
1-(4-ethyl-1,4-diazepan-1-yl)-3-[(2-methoxyphenyl)methoxy]propan-2-ol
CID 111102960
1-(2-fluoro-3-methylphenoxy)-3-[(2-methoxyphenyl)methoxy]propan-2-ol
CID 110017824
1-[cyclobutyl(methyl)amino]-3-[(2-methoxyphenyl)methoxy]propan-2-ol
CID 111488960
[2-(tert-butylamino)-2-oxoethyl]-ethyl-[(2S)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]azanium
CID 2087020
3-(2-methoxyphenyl)-2-methylpropan-1-amine
CID 22024848
1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-3-[(2-methoxyphenyl)methoxy]propan-2-ol
CID 74626402
(3R)-1-[(2R)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]piperidin-3-ol
CID 100848872
(2S)-1-[(2-methoxyphenyl)methoxy]-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-2-ol
CID 25490234
1-(2-fluoro-6-methoxyphenoxy)-3-[(2-fluorophenyl)methoxy]propan-2-ol
CID 109416030

Frequently Asked Questions

What is the IUPAC name of (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol?
The IUPAC name of (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol (CID 97180175) is (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol.
What is the SMILES notation for (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol?
The canonical SMILES for (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol is COc1ccccc1COC[C@H](O)CN.
What is the InChIKey of (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol?
The InChIKey is FVLWSVPFAZFPOQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H17NO3/c1-14-11-5-3-2-4-9(11)7-15-8-10(13)6-12/h2-5,10,13H,6-8,12H2,1H3/t10-/m1/s1.
What are the key properties of (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol?
(2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol has a molecular weight of 211.26 g/mol, XLogP of 0.53, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-amino-3-[(2-methoxyphenyl)methoxy]propan-2-ol is sourced from PubChem (CID 97180175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).