1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol

C16H20O2 — CID 105114348

IUPAC1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol
SMILESCC(C)OCC(O)Cc1ccc2ccccc2c1
InChIInChI=1S/C16H20O2/c1-12(2)18-11-16(17)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9,12,16-17H,10-11H2,1-2H3
InChIKeyRYOCWNDQLAVDOL-UHFFFAOYSA-N
MW244.33 g/mol
LogP3.17
Rot. Bonds5

About 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol

1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol (PubChem CID 105114348) has the molecular formula C16H20O2 and a molecular weight of 244.33 g/mol. Its IUPAC name is 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol.

Molecular Properties

Compound Name1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol
PubChem CID105114348
Molecular FormulaC16H20O2
Molecular Weight244.33 g/mol
Exact Mass244.15
IUPAC Name1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol
SMILESCC(C)OCC(O)Cc1ccc2ccccc2c1
InChIInChI=1S/C16H20O2/c1-12(2)18-11-16(17)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9,12,16-17H,10-11H2,1-2H3
InChIKeyRYOCWNDQLAVDOL-UHFFFAOYSA-N
XLogP3.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-3-naphthalen-2-ylpropan-2-ol
CID 105112115
2-methyl-3-naphthalen-2-ylpropane-1,1-diol
CID 20647932
1-anthracen-2-ylbutan-2-ol
CID 141488114
1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol
CID 105076762
1-(3-fluorophenyl)-3-naphthalen-2-ylpropan-2-ol
CID 105079027
(1S)-2-naphthalen-2-yl-1-phenylethanol
CID 101378142
(2R)-1-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]-3-(1-phenylpropan-2-yloxy)propan-2-ol
CID 46891320
4-ethyl-1-naphthalen-2-yloctan-2-ol
CID 105080592
1-naphthalen-2-ylhept-6-yn-2-ol
CID 105124705
propan-2-yl 3-naphthalen-2-yl-2-(propan-2-ylamino)propanoate
CID 156677951
methyl 3-amino-2-hydroxy-4-naphthalen-2-ylbutanoate
CID 154647583
1-(1-methylpyrazol-3-yl)-2-naphthalen-2-ylethanol
CID 103138401

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol?
The IUPAC name of 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol (CID 105114348) is 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol.
What is the SMILES notation for 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol?
The canonical SMILES for 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol is CC(C)OCC(O)Cc1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol?
The InChIKey is RYOCWNDQLAVDOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O2/c1-12(2)18-11-16(17)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9,12,16-17H,10-11H2,1-2H3.
What are the key properties of 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol?
1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol has a molecular weight of 244.33 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol is sourced from PubChem (CID 105114348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).