(2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol

C15H27NO2Si — CID 68903727

IUPAC(2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol
SMILESCC(C)(Cc1ccc(C[C@@H](N)CO)cc1)[Si](C)(C)O
InChIInChI=1S/C15H27NO2Si/c1-15(2,19(3,4)18)10-13-7-5-12(6-8-13)9-14(16)11-17/h5-8,14,17-18H,9-11,16H2,1-4H3/t14-/m1/s1
InChIKeyMJYJYJOWZJYONR-CQSZACIVSA-N
MW281.47 g/mol
LogP2.07
Rot. Bonds6

About (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol

(2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol (PubChem CID 68903727) has the molecular formula C15H27NO2Si and a molecular weight of 281.47 g/mol. Its IUPAC name is (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol.

Molecular Properties

Compound Name(2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol
PubChem CID68903727
Molecular FormulaC15H27NO2Si
Molecular Weight281.47 g/mol
Exact Mass281.18
IUPAC Name(2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol
SMILESCC(C)(Cc1ccc(C[C@@H](N)CO)cc1)[Si](C)(C)O
InChIInChI=1S/C15H27NO2Si/c1-15(2,19(3,4)18)10-13-7-5-12(6-8-13)9-14(16)11-17/h5-8,14,17-18H,9-11,16H2,1-4H3/t14-/m1/s1
InChIKeyMJYJYJOWZJYONR-CQSZACIVSA-N
XLogP2.07
TPSA66.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 52.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol?
The IUPAC name of (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol (CID 68903727) is (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol.
What is the SMILES notation for (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol?
The canonical SMILES for (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol is CC(C)(Cc1ccc(C[C@@H](N)CO)cc1)[Si](C)(C)O.
What is the InChIKey of (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol?
The InChIKey is MJYJYJOWZJYONR-CQSZACIVSA-N. The full InChI is InChI=1S/C15H27NO2Si/c1-15(2,19(3,4)18)10-13-7-5-12(6-8-13)9-14(16)11-17/h5-8,14,17-18H,9-11,16H2,1-4H3/t14-/m1/s1.
What are the key properties of (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol?
(2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol has a molecular weight of 281.47 g/mol, XLogP of 2.07, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]propan-1-ol is sourced from PubChem (CID 68903727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).