(2R)-2-(benzylamino)-3-phenylpropan-1-ol

C16H19NO — CID 10900780

IUPAC(2R)-2-(benzylamino)-3-phenylpropan-1-ol
SMILESOC[C@@H](Cc1ccccc1)NCc1ccccc1
InChIInChI=1S/C16H19NO/c18-13-16(11-14-7-3-1-4-8-14)17-12-15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-/m1/s1
InChIKeyLHXDBXYWIPUULZ-MRXNPFEDSA-N
MW241.33 g/mol
LogP2.38
Rot. Bonds6

About (2R)-2-(benzylamino)-3-phenylpropan-1-ol

(2R)-2-(benzylamino)-3-phenylpropan-1-ol (PubChem CID 10900780) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is (2R)-2-(benzylamino)-3-phenylpropan-1-ol.

Molecular Properties

Compound Name(2R)-2-(benzylamino)-3-phenylpropan-1-ol
PubChem CID10900780
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name(2R)-2-(benzylamino)-3-phenylpropan-1-ol
SMILESOC[C@@H](Cc1ccccc1)NCc1ccccc1
InChIInChI=1S/C16H19NO/c18-13-16(11-14-7-3-1-4-8-14)17-12-15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-/m1/s1
InChIKeyLHXDBXYWIPUULZ-MRXNPFEDSA-N
XLogP2.38
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Benzylethanolamine
CID 4348
2-((1-Phenylethyl)amino)ethan-1-ol
CID 14909
N,N-Dibenzylethanolamine
CID 22657
Benzyl alcohol, alpha-(phenethylamino)methyl-
CID 20118
alpha-((Cyclohexylamino)methyl)benzenemethanol
CID 23064
[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol
CID 723422
(1,2,3,4-Tetrahydro-isoquinolin-3-yl)-methanol
CID 3752277
2-(Benzylamino)-1-phenylethanol
CID 229746
1,3-Propanediol, 2-(((1,1'-biphenyl)-4-ylmethyl)amino)-2-methyl-, hydrochloride
CID 149654
2-Amino-2-phenylethanol
CID 92466
2-(Benzylamino)propan-1-ol
CID 138873
[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol
CID 776757

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(benzylamino)-3-phenylpropan-1-ol?
The IUPAC name of (2R)-2-(benzylamino)-3-phenylpropan-1-ol (CID 10900780) is (2R)-2-(benzylamino)-3-phenylpropan-1-ol.
What is the SMILES notation for (2R)-2-(benzylamino)-3-phenylpropan-1-ol?
The canonical SMILES for (2R)-2-(benzylamino)-3-phenylpropan-1-ol is OC[C@@H](Cc1ccccc1)NCc1ccccc1.
What is the InChIKey of (2R)-2-(benzylamino)-3-phenylpropan-1-ol?
The InChIKey is LHXDBXYWIPUULZ-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H19NO/c18-13-16(11-14-7-3-1-4-8-14)17-12-15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-/m1/s1.
What are the key properties of (2R)-2-(benzylamino)-3-phenylpropan-1-ol?
(2R)-2-(benzylamino)-3-phenylpropan-1-ol has a molecular weight of 241.33 g/mol, XLogP of 2.38, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(benzylamino)-3-phenylpropan-1-ol is sourced from PubChem (CID 10900780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).