1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol

C19H22N2O2 — CID 109411288

IUPAC1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol
SMILESCCCc1nccn1CC(O)COc1cccc2ccccc12
InChIInChI=1S/C19H22N2O2/c1-2-6-19-20-11-12-21(19)13-16(22)14-23-18-10-5-8-15-7-3-4-9-17(15)18/h3-5,7-12,16,22H,2,6,13-14H2,1H3
InChIKeyDRMMTOIFXVDWSF-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.43
Rot. Bonds7

About 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol

1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol (PubChem CID 109411288) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol
PubChem CID109411288
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol
SMILESCCCc1nccn1CC(O)COc1cccc2ccccc12
InChIInChI=1S/C19H22N2O2/c1-2-6-19-20-11-12-21(19)13-16(22)14-23-18-10-5-8-15-7-3-4-9-17(15)18/h3-5,7-12,16,22H,2,6,13-14H2,1H3
InChIKeyDRMMTOIFXVDWSF-UHFFFAOYSA-N
XLogP3.43
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-naphthalen-1-yloxy-3-(2-pyrazin-2-ylimidazol-1-yl)propan-2-ol
CID 109411438
(2R)-1-(3-methylbenzimidazol-3-ium-1-yl)-3-naphthalen-1-yloxypropan-2-ol
CID 40503008
1-(2,5-dimethylphenoxy)-3-(2-ethylimidazol-1-yl)propan-2-ol
CID 109411226
(2R)-1-(3-methyl-2-propylbenzimidazol-3-ium-1-yl)-3-naphthalen-1-yloxypropan-2-ol
CID 991935
1-naphthalen-1-yloxyundecan-2-ol
CID 2793899
1-ethyl-3-[(2R)-2-hydroxy-3-naphthalen-1-yloxypropyl]benzimidazol-2-one
CID 52566005
1-naphthalen-1-yloxy-3-piperidin-1-ylpropan-2-ol;hydrochloride
CID 14556459
1-(2-propan-2-ylimidazol-1-yl)-3-(2-propan-2-ylphenoxy)propan-2-ol
CID 109411232
(2S)-1-(2-methylphenoxy)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol
CID 125135773
(2-hydroxy-3-naphthalen-1-yloxypropyl)-propan-2-ylazanium chloride
CID 43834240
(2R)-1-(1H-indol-4-yloxy)-3-(2-propan-2-ylimidazol-1-yl)propan-2-ol
CID 97327080
(2R)-1-(5-tert-butyltetrazol-1-yl)-3-naphthalen-1-yloxypropan-2-ol
CID 94333689

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol?
The IUPAC name of 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol (CID 109411288) is 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol.
What is the SMILES notation for 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol?
The canonical SMILES for 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol is CCCc1nccn1CC(O)COc1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol?
The InChIKey is DRMMTOIFXVDWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-2-6-19-20-11-12-21(19)13-16(22)14-23-18-10-5-8-15-7-3-4-9-17(15)18/h3-5,7-12,16,22H,2,6,13-14H2,1H3.
What are the key properties of 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol?
1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol has a molecular weight of 310.40 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yloxy-3-(2-propylimidazol-1-yl)propan-2-ol is sourced from PubChem (CID 109411288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).