2-pentyl-1,2,3,4-tetrahydronaphthalene

C15H22 — CID 14298811

IUPAC2-pentyl-1,2,3,4-tetrahydronaphthalene
SMILESCCCCCC1CCc2ccccc2C1
InChIInChI=1S/C15H22/c1-2-3-4-7-13-10-11-14-8-5-6-9-15(14)12-13/h5-6,8-9,13H,2-4,7,10-12H2,1H3
InChIKeyNRFCKFIKYUTXGZ-UHFFFAOYSA-N
MW202.34 g/mol
LogP4.37
Rot. Bonds4

About 2-pentyl-1,2,3,4-tetrahydronaphthalene

2-pentyl-1,2,3,4-tetrahydronaphthalene (PubChem CID 14298811) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is 2-pentyl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name2-pentyl-1,2,3,4-tetrahydronaphthalene
PubChem CID14298811
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name2-pentyl-1,2,3,4-tetrahydronaphthalene
SMILESCCCCCC1CCc2ccccc2C1
InChIInChI=1S/C15H22/c1-2-3-4-7-13-10-11-14-8-5-6-9-15(14)12-13/h5-6,8-9,13H,2-4,7,10-12H2,1H3
InChIKeyNRFCKFIKYUTXGZ-UHFFFAOYSA-N
XLogP4.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-propyl-1,2,3,4-tetrahydronaphthalene
CID 13330225
3-(1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-ol
CID 67879898
2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene
CID 102001272
2-(2-bromoethyl)-1,2,3,4-tetrahydronaphthalene
CID 15752629
6-[2-(4-pentylcyclohexyl)ethyl]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 139877548
2-(2-methylsulfanylethyl)-1,2,3,4-tetrahydronaphthalene
CID 143252120
6-(4-butylcyclohexyl)-2-pentyl-1,2,3,4-tetrahydronaphthalene
CID 20500738
6-decyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CID 139896307
2-heptyl-6-(4-hexylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 20500542
6,7-difluoro-2-[2-(4-pentylcyclohexyl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 139848305
2-nonyl-1,2,3,4-tetrahydroxanthen-10-ium
CID 21312472
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
CID 86313684

Frequently Asked Questions

What is the IUPAC name of 2-pentyl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 2-pentyl-1,2,3,4-tetrahydronaphthalene (CID 14298811) is 2-pentyl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 2-pentyl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 2-pentyl-1,2,3,4-tetrahydronaphthalene is CCCCCC1CCc2ccccc2C1.
What is the InChIKey of 2-pentyl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is NRFCKFIKYUTXGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22/c1-2-3-4-7-13-10-11-14-8-5-6-9-15(14)12-13/h5-6,8-9,13H,2-4,7,10-12H2,1H3.
What are the key properties of 2-pentyl-1,2,3,4-tetrahydronaphthalene?
2-pentyl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 202.34 g/mol, XLogP of 4.37, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pentyl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 14298811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).