3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol

C17H26O — CID 82920616

IUPAC3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol
SMILESCCC(CC)CC(O)C1CCCc2ccccc21
InChIInChI=1S/C17H26O/c1-3-13(4-2)12-17(18)16-11-7-9-14-8-5-6-10-15(14)16/h5-6,8,10,13,16-18H,3-4,7,9,11-12H2,1-2H3
InChIKeyAWHBASXTCJECCO-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.29
Rot. Bonds5

About 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol

3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol (PubChem CID 82920616) has the molecular formula C17H26O and a molecular weight of 246.39 g/mol. Its IUPAC name is 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol
PubChem CID82920616
Molecular FormulaC17H26O
Molecular Weight246.39 g/mol
Exact Mass246.20
IUPAC Name3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol
SMILESCCC(CC)CC(O)C1CCCc2ccccc21
InChIInChI=1S/C17H26O/c1-3-13(4-2)12-17(18)16-11-7-9-14-8-5-6-10-15(14)16/h5-6,8,10,13,16-18H,3-4,7,9,11-12H2,1-2H3
InChIKeyAWHBASXTCJECCO-UHFFFAOYSA-N
XLogP4.29
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,3-dihydro-1H-inden-1-yl)-3-ethylpentan-1-ol
CID 82920522
1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol
CID 18690782
2-cyclopropyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 64906726
1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 63247593
2-(2-chlorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 63247324
3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)pentan-1-ol
CID 82920523
ethane;1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 144539733
1-(1,2,3,4-tetrahydronaphthalen-1-yl)-3-thiophen-2-ylpropan-1-ol
CID 63773868
1-icosan-8-yl-1,2,3,4-tetrahydronaphthalene
CID 175494887
N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
CID 55175096
2-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]propanamide
CID 140759820
2-(3-chloro-4-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 103039582

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol?
The IUPAC name of 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol (CID 82920616) is 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol.
What is the SMILES notation for 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol?
The canonical SMILES for 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol is CCC(CC)CC(O)C1CCCc2ccccc21.
What is the InChIKey of 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol?
The InChIKey is AWHBASXTCJECCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-3-13(4-2)12-17(18)16-11-7-9-14-8-5-6-10-15(14)16/h5-6,8,10,13,16-18H,3-4,7,9,11-12H2,1-2H3.
What are the key properties of 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol?
3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol has a molecular weight of 246.39 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol is sourced from PubChem (CID 82920616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).