2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene

C16H24 — CID 102001272

IUPAC2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene
SMILESCC(C)CCCC1CCc2ccccc2C1
InChIInChI=1S/C16H24/c1-13(2)6-5-7-14-10-11-15-8-3-4-9-16(15)12-14/h3-4,8-9,13-14H,5-7,10-12H2,1-2H3
InChIKeyQWFRIFIGFCZQOD-UHFFFAOYSA-N
MW216.37 g/mol
LogP4.62
Rot. Bonds4

About 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene

2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 102001272) has the molecular formula C16H24 and a molecular weight of 216.37 g/mol. Its IUPAC name is 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID102001272
Molecular FormulaC16H24
Molecular Weight216.37 g/mol
Exact Mass216.19
IUPAC Name2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene
SMILESCC(C)CCCC1CCc2ccccc2C1
InChIInChI=1S/C16H24/c1-13(2)6-5-7-14-10-11-15-8-3-4-9-16(15)12-14/h3-4,8-9,13-14H,5-7,10-12H2,1-2H3
InChIKeyQWFRIFIGFCZQOD-UHFFFAOYSA-N
XLogP4.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-pentyl-1,2,3,4-tetrahydronaphthalene
CID 14298811
3-(1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-ol
CID 67879898
2-propyl-1,2,3,4-tetrahydronaphthalene
CID 13330225
2-(2-methylsulfanylethyl)-1,2,3,4-tetrahydronaphthalene
CID 143252120
2-(2-bromoethyl)-1,2,3,4-tetrahydronaphthalene
CID 15752629
3-(4-methylpentyl)-1,2,3,4-tetrahydroquinoline
CID 106781112
N,5-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)hexan-1-amine
CID 83161896
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
CID 86313684
2-(methylsulfanylmethyl)-1,2,3,4-tetrahydronaphthalene
CID 130736237
2,3-dimethyl-4-oxo-6-(1,2,3,4-tetrahydronaphthalen-2-yl)hexanamide
CID 143154179
N-methyl-2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 83157787
3-methoxy-6-(5-methylhexyl)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 10286122

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene (CID 102001272) is 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene is CC(C)CCCC1CCc2ccccc2C1.
What is the InChIKey of 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is QWFRIFIGFCZQOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24/c1-13(2)6-5-7-14-10-11-15-8-3-4-9-16(15)12-14/h3-4,8-9,13-14H,5-7,10-12H2,1-2H3.
What are the key properties of 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene?
2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 216.37 g/mol, XLogP of 4.62, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 102001272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).