2-(oxolan-3-ylamino)-2-phenylpropan-1-ol

C13H19NO2 — CID 115920302

IUPAC2-(oxolan-3-ylamino)-2-phenylpropan-1-ol
SMILESCC(CO)(NC1CCOC1)c1ccccc1
InChIInChI=1S/C13H19NO2/c1-13(10-15,11-5-3-2-4-6-11)14-12-7-8-16-9-12/h2-6,12,14-15H,7-10H2,1H3
InChIKeySLNUORFBMTZYBR-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.27
Rot. Bonds4

About 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol

2-(oxolan-3-ylamino)-2-phenylpropan-1-ol (PubChem CID 115920302) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol.

Molecular Properties

Compound Name2-(oxolan-3-ylamino)-2-phenylpropan-1-ol
PubChem CID115920302
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-(oxolan-3-ylamino)-2-phenylpropan-1-ol
SMILESCC(CO)(NC1CCOC1)c1ccccc1
InChIInChI=1S/C13H19NO2/c1-13(10-15,11-5-3-2-4-6-11)14-12-7-8-16-9-12/h2-6,12,14-15H,7-10H2,1H3
InChIKeySLNUORFBMTZYBR-UHFFFAOYSA-N
XLogP1.27
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3R,4S)-2-((((1R)-2-hydroxy-1-phenylethyl)amino)methyl)pyrrolidine-3,4-diol
CID 11425273
(2R,3R,4S,5S)-2-(Hydroxymethyl)-5-phenylpyrrolidine-3,4-diol
CID 9837195
2-(Benzylamino)-2-phenylethan-1-ol
CID 234875
N-(2-hydroxy-1-phenylethyl)acetamide
CID 15619841
(2S,3S,4S)-2-(hydroxymethyl)-2-phenylpyrrolidine-3,4-diol
CID 168278373
(2S,3S,4S)-2-(3-fluorophenyl)-2-(hydroxymethyl)pyrrolidine-3,4-diol
CID 168281304
(2R,3R,4R)-2-(4-fluorophenyl)-2-(hydroxymethyl)pyrrolidine-3,4-diol
CID 168286908
(2S,3S,4S)-2-(hydroxymethyl)-2-(4-methylphenyl)pyrrolidine-3,4-diol
CID 168289178
(2R,3R,4R)-2-(4-phenylphenyl)pyrrolidine-3,4-diol;hydrochloride
CID 168293905
(R)-(-)-N-Benzyl-2-phenylglycinol
CID 10656907
3-Phenylmorpholine
CID 3613837
beta-(Methylamino)benzeneethanol
CID 12247455

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol?
The IUPAC name of 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol (CID 115920302) is 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol.
What is the SMILES notation for 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol?
The canonical SMILES for 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol is CC(CO)(NC1CCOC1)c1ccccc1.
What is the InChIKey of 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol?
The InChIKey is SLNUORFBMTZYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-13(10-15,11-5-3-2-4-6-11)14-12-7-8-16-9-12/h2-6,12,14-15H,7-10H2,1H3.
What are the key properties of 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol?
2-(oxolan-3-ylamino)-2-phenylpropan-1-ol has a molecular weight of 221.30 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-ylamino)-2-phenylpropan-1-ol is sourced from PubChem (CID 115920302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).