1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol

C19H23NO2 — CID 3804893

IUPAC1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol
SMILESOC(COCc1ccccc1)CN1CCCc2ccccc21
InChIInChI=1S/C19H23NO2/c21-18(15-22-14-16-7-2-1-3-8-16)13-20-12-6-10-17-9-4-5-11-19(17)20/h1-5,7-9,11,18,21H,6,10,12-15H2
InChIKeyJZILYORZOSMKBH-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.02
Rot. Bonds6

About 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol

1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol (PubChem CID 3804893) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol
PubChem CID3804893
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol
SMILESOC(COCc1ccccc1)CN1CCCc2ccccc21
InChIInChI=1S/C19H23NO2/c21-18(15-22-14-16-7-2-1-3-8-16)13-20-12-6-10-17-9-4-5-11-19(17)20/h1-5,7-9,11,18,21H,6,10,12-15H2
InChIKeyJZILYORZOSMKBH-UHFFFAOYSA-N
XLogP3.02
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-1-(1,3-benzodioxol-5-ylmethoxy)-3-(3,4-dihydro-2H-quinolin-1-yl)propan-2-ol
CID 95576385
1-(3,4-dihydro-2H-quinolin-1-yl)-3-(thiophen-2-ylmethoxy)propan-2-ol
CID 86912362
1-phenylmethoxy-3-(1,2,3,4-tetrahydro-1,5-benzodiazepin-5-yl)propan-2-ol
CID 136562043
1-(3,4-dihydro-2H-quinolin-1-yl)-3-(2-ethylhexoxy)propan-2-ol
CID 143232672
(2S,11R)-1,12-bis(3,4-dihydro-2H-quinolin-1-yl)dodecane-2,11-diol
CID 92532372
1-(3,4-dihydro-2H-quinolin-1-yl)-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991698
(2S)-1-phenylmethoxy-3-pyrrolidin-1-ylpropan-2-ol
CID 740501
1-phenylmethoxy-3-pyrrolidin-1-ylpropan-2-ol chloride
CID 53346846
1-phenylmethoxy-3-piperidin-1-ylpropan-2-ol
CID 2769742
1-phenylmethoxy-3-piperidin-1-ylpropan-2-ol chloride
CID 21236635
2-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-hydroxypropyl]guanidine
CID 3095129
N-[2-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-hydroxypropoxy]phenyl]acetamide
CID 3558526

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol?
The IUPAC name of 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol (CID 3804893) is 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol.
What is the SMILES notation for 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol?
The canonical SMILES for 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol is OC(COCc1ccccc1)CN1CCCc2ccccc21.
What is the InChIKey of 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol?
The InChIKey is JZILYORZOSMKBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c21-18(15-22-14-16-7-2-1-3-8-16)13-20-12-6-10-17-9-4-5-11-19(17)20/h1-5,7-9,11,18,21H,6,10,12-15H2.
What are the key properties of 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol?
1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol has a molecular weight of 297.40 g/mol, XLogP of 3.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol is sourced from PubChem (CID 3804893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).