1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol

C18H22O2 — CID 103160605

IUPAC1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol
SMILESOC(COc1cccc2ccccc12)CC1CCCC1
InChIInChI=1S/C18H22O2/c19-16(12-14-6-1-2-7-14)13-20-18-11-5-9-15-8-3-4-10-17(15)18/h3-5,8-11,14,16,19H,1-2,6-7,12-13H2
InChIKeyDDRKKJOTEXOPFG-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.16
Rot. Bonds5

About 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol

1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol (PubChem CID 103160605) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol
PubChem CID103160605
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol
SMILESOC(COc1cccc2ccccc12)CC1CCCC1
InChIInChI=1S/C18H22O2/c19-16(12-14-6-1-2-7-14)13-20-18-11-5-9-15-8-3-4-10-17(15)18/h3-5,8-11,14,16,19H,1-2,6-7,12-13H2
InChIKeyDDRKKJOTEXOPFG-UHFFFAOYSA-N
XLogP4.16
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-2-naphthalen-1-yloxyethanol
CID 104753513
1-cyclopentyl-3-(2-methoxyphenoxy)propan-2-ol
CID 103160603
(2R)-1-(cycloheptylamino)-3-naphthalen-1-yloxypropan-2-ol
CID 2086464
(2S)-1-(cycloheptylamino)-3-naphthalen-1-yloxypropan-2-ol
CID 2086466
1-cyclopentyl-3-[2-(1-hydroxypropyl)phenoxy]propan-2-ol
CID 103158943
4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol
CID 103158985
1-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperidin-3-ol
CID 18081673
(2S)-1-naphthalen-1-yloxy-3-piperidin-1-ium-1-ylpropan-2-ol
CID 7385672
4-amino-1-naphthalen-1-yloxybutan-2-ol
CID 86215876
1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine
CID 63912716
1-naphthalen-1-yloxy-3-piperidin-1-ylpropan-2-ol;hydrochloride
CID 14556459
1-[2-(hydroxymethyl)pyrrolidin-1-yl]-3-naphthalen-1-yloxypropan-2-ol
CID 111103265

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol?
The IUPAC name of 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol (CID 103160605) is 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol is OC(COc1cccc2ccccc12)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol?
The InChIKey is DDRKKJOTEXOPFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c19-16(12-14-6-1-2-7-14)13-20-18-11-5-9-15-8-3-4-10-17(15)18/h3-5,8-11,14,16,19H,1-2,6-7,12-13H2.
What are the key properties of 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol?
1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol has a molecular weight of 270.37 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol is sourced from PubChem (CID 103160605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).