(R)-3-Amino-3-phenylpropan-1-ol

C₉H₁₃NOCAS 170564-98-4151.21 g/mol

Open in Covalent MOL file

Alcohol Primary amine

Properties

Molecular formula: C₉H₁₃NO
Molar mass: 151.21 g/mol
Exact mass: 151.0997 Da
logP: 1.07Crippen estimate
Polar surface area: 46.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 3
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

170564-98-4

SMILES

C1=CC=C(C=C1)[C@@H](CCO)N

InChIKey

SEQXIQNPMQTBGN-SECBINFHSA-N

InChI

InChI=1S/C9H13NO/c10-9(6-7-11)8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2/t9-/m1/s1

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Names and synonyms

1 names

(R)-1-Phenyl-3-propanolamine

Work with (R)-3-Amino-3-phenylpropan-1-ol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(-)-3-Amino-3-phenylpropanol82769-76-4100 % similar (+)-Phenylglycinol20989-17-763 % similar (-)-Phenylglycinol56613-80-063 % similar Phenylglycinol7568-92-563 % similar γ-Phenylbenzenepropanol20017-67-859 % similar 1,2-Diphenylethylamine25611-78-352 % similar 1-Phenylpropylamine2941-20-052 % similar (+)-1-Phenylpropylamine3082-64-252 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Benzylethanolamine104-63-2 3-Ethylamino-P-cresol120-37-6 γ-Aminobenzenepropanol14593-04-5 3-Methoxy-N,N-dimethylbenzenamine15799-79-8 Phenylalaninol16088-07-6 4-(Dimethylamino)benzyl alcohol1703-46-4 3-Methoxyphenethylamine2039-67-0 2-Methoxyphenethylamine2045-79-6

Elsewhere

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