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

C17H18 — CID 159713815

IUPAC1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene
SMILESCc1ccc(C2CCCc3ccccc32)cc1
InChIInChI=1S/C17H18/c1-13-9-11-15(12-10-13)17-8-4-6-14-5-2-3-7-16(14)17/h2-3,5,7,9-12,17H,4,6,8H2,1H3
InChIKeyOOKZCRJUSICLJN-UHFFFAOYSA-N
MW222.33 g/mol
LogP4.46
Rot. Bonds1

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

1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 159713815) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID159713815
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene
SMILESCc1ccc(C2CCCc3ccccc32)cc1
InChIInChI=1S/C17H18/c1-13-9-11-15(12-10-13)17-8-4-6-14-5-2-3-7-16(14)17/h2-3,5,7,9-12,17H,4,6,8H2,1H3
InChIKeyOOKZCRJUSICLJN-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]phenol
CID 93476534
2-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-yl)phenol
CID 18930041
1-(4-methoxy-3-methylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 54031428
acetamide;1-(3,4-dimethylphenyl)-1,2,3,4-tetrahydronaphthalene;ethane
CID 142409210
1-(3-bromophenyl)-1,2,3,4-tetrahydronaphthalene
CID 22613084
2-methyl-6-(1,2,3,4-tetrahydronaphthalen-1-yl)phenol
CID 13136042
3-methyl-2,4-dioxo-4-[4-(1,2,3,4-tetrahydronaphthalen-1-yl)phenyl]butanoic acid
CID 20535220
(1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 132584955
1-(2-ethylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 23310853
1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene
CID 173404050
4,6-dichloro-5-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidine
CID 55217602
1-methyl-4-(2-methylidenecyclopentyl)benzene
CID 166116595

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene (CID 159713815) is 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene is Cc1ccc(C2CCCc3ccccc32)cc1.
What is the InChIKey of 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is OOKZCRJUSICLJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18/c1-13-9-11-15(12-10-13)17-8-4-6-14-5-2-3-7-16(14)17/h2-3,5,7,9-12,17H,4,6,8H2,1H3.
What are the key properties of 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene?
1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 222.33 g/mol, XLogP of 4.46, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 159713815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).