2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol

C15H25NO2 — CID 82960332

IUPAC2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol
SMILESCOCCN(C(C)C)C(C)C(O)c1ccccc1
InChIInChI=1S/C15H25NO2/c1-12(2)16(10-11-18-4)13(3)15(17)14-8-6-5-7-9-14/h5-9,12-13,15,17H,10-11H2,1-4H3
InChIKeyYSRFZBHRQBOHRQ-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.47
Rot. Bonds7

About 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol

2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol (PubChem CID 82960332) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol.

Molecular Properties

Compound Name2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol
PubChem CID82960332
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol
SMILESCOCCN(C(C)C)C(C)C(O)c1ccccc1
InChIInChI=1S/C15H25NO2/c1-12(2)16(10-11-18-4)13(3)15(17)14-8-6-5-7-9-14/h5-9,12-13,15,17H,10-11H2,1-4H3
InChIKeyYSRFZBHRQBOHRQ-UHFFFAOYSA-N
XLogP2.47
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one
CID 82952096
(1S)-2-[2-[[(1S)-1-hydroxy-1-phenylpropan-2-yl]-methylamino]ethyl-methylamino]-1-phenylpropan-1-ol
CID 102595877
4-[1-[2-methoxyethyl(propan-2-yl)amino]ethyl]phenol
CID 82982782
N,N,N',N'-tetrakis(2-methoxyethyl)-1,2-diphenylethane-1,2-diamine
CID 613655
(1S,2R)-2-(dipropylamino)-1-phenylpropan-1-ol
CID 11118019
2-[ethyl(methyl)amino]-1-phenylpropan-1-ol
CID 10734
(1S,2S)-1-methoxy-N-(2-methoxyethyl)-N-methyl-1-phenylpropan-2-amine
CID 11447743
(1R,2S)-2-[2,2-dimethoxyethyl(methyl)amino]-1-phenylpropan-1-ol
CID 102421960
(2R)-2-(dimethylamino)-1-phenylpropan-1-ol;hydrochloride
CID 163285620
(1S,2R)-2-(dimethylamino)-1-phenylpropan-1-ol;hydrochloride
CID 3041454
(1S,2S)-2-(dibutylamino)-1-phenylpropan-1-ol
CID 14112556
(1S)-2-(dibutylamino)-1-phenylpropan-1-ol
CID 70156546

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol?
The IUPAC name of 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol (CID 82960332) is 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol.
What is the SMILES notation for 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol?
The canonical SMILES for 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol is COCCN(C(C)C)C(C)C(O)c1ccccc1.
What is the InChIKey of 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol?
The InChIKey is YSRFZBHRQBOHRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-12(2)16(10-11-18-4)13(3)15(17)14-8-6-5-7-9-14/h5-9,12-13,15,17H,10-11H2,1-4H3.
What are the key properties of 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol?
2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol has a molecular weight of 251.37 g/mol, XLogP of 2.47, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol is sourced from PubChem (CID 82960332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).