2-propyl-1,2,3,4-tetrahydronaphthalene

C13H18 — CID 13330225

IUPAC2-propyl-1,2,3,4-tetrahydronaphthalene
SMILESCCCC1CCc2ccccc2C1
InChIInChI=1S/C13H18/c1-2-5-11-8-9-12-6-3-4-7-13(12)10-11/h3-4,6-7,11H,2,5,8-10H2,1H3
InChIKeyWCPBRIKLXLQGRY-UHFFFAOYSA-N
MW174.29 g/mol
LogP3.59
Rot. Bonds2

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

2-propyl-1,2,3,4-tetrahydronaphthalene (PubChem CID 13330225) has the molecular formula C13H18 and a molecular weight of 174.29 g/mol. Its IUPAC name is 2-propyl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name2-propyl-1,2,3,4-tetrahydronaphthalene
PubChem CID13330225
Molecular FormulaC13H18
Molecular Weight174.29 g/mol
Exact Mass174.14
IUPAC Name2-propyl-1,2,3,4-tetrahydronaphthalene
SMILESCCCC1CCc2ccccc2C1
InChIInChI=1S/C13H18/c1-2-5-11-8-9-12-6-3-4-7-13(12)10-11/h3-4,6-7,11H,2,5,8-10H2,1H3
InChIKeyWCPBRIKLXLQGRY-UHFFFAOYSA-N
XLogP3.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-pentyl-1,2,3,4-tetrahydronaphthalene
CID 14298811
2-(2-bromoethyl)-1,2,3,4-tetrahydronaphthalene
CID 15752629
6-propyl-5,6,7,8-tetrahydrobenzo[7]annulen-9-one
CID 70170867
2-(2-methylsulfanylethyl)-1,2,3,4-tetrahydronaphthalene
CID 143252120
3-(1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-ol
CID 67879898
2-(4-methylpentyl)-1,2,3,4-tetrahydronaphthalene
CID 102001272
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
CID 86313684
2-(methylsulfanylmethyl)-1,2,3,4-tetrahydronaphthalene
CID 130736237
6-(3,4-difluorophenyl)-2-propyl-1,2,3,4-tetrahydronaphthalene
CID 22709061
1,2,3,4-tetrahydronaphthalen-2-ylmethylhydrazine
CID 107126485
(2S)-2-prop-2-enyl-1,2,3,4-tetrahydronaphthalene
CID 129383765
4-(6-propyl-5,6,7,8-tetrahydronaphthalen-2-yl)benzonitrile
CID 20500208

Frequently Asked Questions

What is the IUPAC name of 2-propyl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 2-propyl-1,2,3,4-tetrahydronaphthalene (CID 13330225) is 2-propyl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 2-propyl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 2-propyl-1,2,3,4-tetrahydronaphthalene is CCCC1CCc2ccccc2C1.
What is the InChIKey of 2-propyl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is WCPBRIKLXLQGRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18/c1-2-5-11-8-9-12-6-3-4-7-13(12)10-11/h3-4,6-7,11H,2,5,8-10H2,1H3.
What are the key properties of 2-propyl-1,2,3,4-tetrahydronaphthalene?
2-propyl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 174.29 g/mol, XLogP of 3.59, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 13330225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).